SCHEMBL503797

SCHEMBL503797

CCCCCN(C(=S)S)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 3/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
ADH1C P00326 2/20 0.35
ADH4 P08319 1/20 0.35
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
CYP1A2 P05177 2/20 0.34
MGLL Q99685 2/20 0.34
FAAH O00519 1/20 0.34
PHGDH O43175 1/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL502635 0.85 HSD17B10 (0.31) ADH1AADH1CADH4THRATHRB
SCHEMBL27944708 0.80 CYP3A4 (0.38) ADH1ATHRATHRBMEN1KMT2A
SCHEMBL503798 0.80 MEN1 (0.35) ADH1ACA12CA1CA2CA9
SCHEMBL11440510 0.80 CA12 (0.37) ADH1ACA12CA1CA2CA9
SCHEMBL4457282 0.80 GAA (0.44) ADH1AADH1CMEN1KMT2ACYP1A2
SCHEMBL28866726 0.79 ADH1A (0.38) ADH1AADH1CMEN1KMT2ACYP1A2
SCHEMBL11494864 0.78 GAA (0.43) ADH1AADH1CMEN1KMT2ACYP1A2
SCHEMBL28805215 0.78 MGLL (0.39) ADH1ACA12CA1CA2CA9
SCHEMBL28827497 0.78 MGLL (0.39) ADH1ACA12CA1CA2CA9
SCHEMBL28827023 0.78 MGLL (0.39) ADH1ACA12CA1CA2CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3311843-A1 COMPOSITIONS COMPRISING DITHIOCARBAMATE AND CYCLODEXTRIN Deutsches Krebsforschungszentrum Stiftung des Öffentlichen Rechts (DE) 2018-04-25 EP claimed
US-20070232692-A1 Method of Treating Cancer Using Dithiocarbamate Derivatives THE UNIVERSITY OF UTAH 2007-10-04 US claimed
US-20230133044-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS BROWN DENNIS M (US) 2023-05-04 US disclosed
US-11541027-B2 Use of dianhydrogalactitol and analogs or derivatives thereof in combination with platinum-containing antineoplastic agents to treat non-small-cell carcinoma of the lung and brain metastases DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2023-01-03 US disclosed
US-11026914-B2 Use of dianhydrogalactitol and analogs and derivatives thereof to treat recurrent malignant glioma or progressive secondary brain tumor DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2021-06-08 US disclosed
EP-3125920-B1 DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL OR DIBROMODULCITOL TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND OVARIAN CANCER DEL MAR PHARMACEUTICALS (CA) 2020-12-23 EP disclosed
US-20190269646-A9 USE OF DIANHYDROGALACTITOL AND ANALOGS OR DERIVATIVES THEREOF IN COMBINATION WITH PLATINUM-CONTAINING ANTINEOPLASTIC AGENTS TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND BRAIN METASTASES DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2019-09-05 US disclosed
US-20190183843-A9 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DELMAR PHARMACEUTICALS, INC. (CA) 2019-06-20 US disclosed
US-20190175541-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DELMAR PHARMACEUTICALS, INC. (CA) 2019-06-13 US disclosed
US-20190091195-A1 USE OF DIANHYDROGALACTITOL AND DERIVATIVES THEREOF IN THE TREATMENT OF GLIOBLASTOMA, LUNG CANCER, AND OVARIAN CANCER DEL MAR PHARMACEUTICALS (CA) 2019-03-28 US disclosed
US-20190015379-A1 USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF, TOGETHER WITH RADIATION, TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME AND SUPPRESS PROLIFERATION OF CANCER STEM CELLS DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2019-01-17 US disclosed
US-5294430-A Side effect reduction of antitumor agents UNIVERSITY OF ROCHESTER (US) 1994-03-15 US disclosed
US-5187193-A Administering dithiocarbamate derivative UNIVERSITY OF ROCHESTER (US) 1993-02-16 US disclosed
EP-0433393-A4 TREATMENT OF DAMAGED BONE MARROW AND DOSAGE UNITS THEREFOR 1992-01-15 EP disclosed
US-5035878-A Reversing bone marrow damage resulting from chemotherapy UNIVERSITY OF ROCHESTER (US) 1991-07-30 US disclosed
EP-0433393-A1 TREATMENT OF DAMAGED BONE MARROW AND DOSAGE UNITS THEREFOR. UNIV ROCHESTER (US) 1991-06-26 EP disclosed
US-4938949-A Combatting side effects of anticancer drugs with dithiocarbamates UNIVERSITY OF NEW YORK (US) 1990-07-03 US disclosed
WO-1990002550-A1 TREATMENT OF DAMAGED BONE MARROW AND DOSAGE UNITS THEREFOR UNIVERSITY OF ROCHESTER (US) 1990-03-22 WO disclosed
US-4594238-A Administering platinum compound; then platimun binding compound REGENTS OF UNIVERSITY OF MINNESOTA (US) 1986-06-10 US disclosed
US-4581224-A ANTITUMOR, ANTRICARCINOGENIC AGENTS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1986-04-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230133044-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS UNG, DPYD, TPMT ADH1A 2944/4885CA12 1360/4885CA1 1837/4885
US-20190175541-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DCK, CDC7, DNMT1 ADH1A 3327/4885CA12 1133/4885CA1 725/4885
US-20190183843-A9 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DCK, CDC7, DNMT1 ADH1A 3327/4885CA12 1133/4885CA1 725/4885
US-20190015379-A1 USE OF DIANHYDROGALACTITOL AND ANALOGS AND DERIVATIVES THEREOF, TOGETHER WITH RADIATION, TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND GLIOBLASTOMA MULTIFORME AND SUPPRESS PROLIFERATION OF CANCER STEM CELLS MGMT, DCLRE1A, DNMT1 ADH1A 196/4885CA12 1160/4885CA1 2097/4885
US-20190269646-A9 USE OF DIANHYDROGALACTITOL AND ANALOGS OR DERIVATIVES THEREOF IN COMBINATION WITH PLATINUM-CONTAINING ANTINEOPLASTIC AGENTS TO TREAT NON-SMALL-CELL CARCINOMA OF THE LUNG AND BRAIN METASTASES DNMT1, MGMT, DCK ADH1A 1265/4885CA12 486/4885CA1 131/4885
US-20190091195-A1 USE OF DIANHYDROGALACTITOL AND DERIVATIVES THEREOF IN THE TREATMENT OF GLIOBLASTOMA, LUNG CANCER, AND OVARIAN CANCER DDOST, DCLRE1A, OGG1 ADH1A 1030/4885CA12 203/4885CA1 343/4885
US-20070232692-A1 Method of Treating Cancer Using Dithiocarbamate Derivatives TST, HCCS, SERPINC1 ADH1A 2667/4885CA12 120/4885CA1 58/4885
US-11026914-B2 Use of dianhydrogalactitol and analogs and derivatives thereof to treat recurrent malignant glioma or progressive secondary brain tumor DDOST, DAD1, PHGDH ADH1A 494/4885CA12 104/4885CA1 165/4885
US-11541027-B2 Use of dianhydrogalactitol and analogs or derivatives thereof in combination with platinum-containing antineoplastic agents to treat non-small-cell carcinoma of the lung and brain metastases DNMT1, MGMT, DCK ADH1A 1265/4885CA12 486/4885CA1 131/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.