SCHEMBL320703

SCHEMBL320703

CCN(CC)C(=O)SSC(=O)N(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
ALDH2 P05091 4/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 3/20 0.46
MGLL Q99685 3/20 0.46
EHMT2 Q96KQ7 3/20 0.46
EHMT1 Q9H9B1 3/20 0.46
TSHR P16473 2/20 0.46
PHGDH O43175 2/20 0.46
ABCB11 O95342 2/20 0.46
HTT P42858 2/20 0.46
GSDMD P57764 2/20 0.46
HTR1A P08908 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
PLIN1 O60240 1/20 0.46
GMNN O75496 1/20 0.46
TRPA1 O75762 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL18017276 0.85 ALDH1A1 (0.73) ALDH1A1ALDH2LMNAKMT2AMGLL
SCHEMBL28574961 0.84 TSHR (0.54) ALDH1A1ALDH2LMNAKMT2AMGLL
S-Methyl Diethylcarbamothioate SCHEMBL1051392 0.79
SCHEMBL11393115 0.77
SCHEMBL27621822 0.77
SCHEMBL24470878 0.77 TSHR (0.46) ALDH1A1ALDH2LMNAKMT2AMGLL
SCHEMBL21221413 0.77 PHGDH (0.50) ALDH1A1ALDH2LMNAKMT2AMGLL
SCHEMBL134304 0.77 TSHR (0.65) ALDH1A1ALDH2LMNAKMT2AMGLL
SCHEMBL4263485 0.75 TSHR (0.62) ALDH1A1ALDH2LMNAKMT2AMGLL
SCHEMBL9420118 0.73 ALDH1A1 (0.49) ALDH1A1ALDH2LMNAKMT2AMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632420-B1 TREATMENT OF FIBROSIS UNIV BIRMINGHAM (GB) 2023-09-27 EP claimed
US-9937133-B2 Treatment of fibrosis UCL BUSINESS PLC (GB) 2018-04-10 US claimed
EP-3137068-A1 TREATMENT OF FIBROSIS UCL Business Plc. (GB) 2017-03-08 EP claimed
US-20170042838-A1 Treatment of Fibrosis THE UNIVERSITY OF BIRMINGHAM (GB) 2017-02-16 US claimed
WO-2015166277-A1 TREATMENT OF FIBROSIS UCL BUSINESS PLC (GB) 2015-11-05 WO claimed
WO-2008045017-A2 SARS AND EBOLA INHIBITORS AND USE THEREOF, AND METHODS FOR THEIR DISCOVERY DIAMOND SCOTT L (US) 2008-04-17 WO claimed
US-20070203073-A1 SARS and Ebola inhibitors and use thereof, and methods for their discovery DIAMOND SCOTT L 2007-08-30 US claimed
US-4412072-A STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-10-25 US claimed
EP-3632420-B1 TREATMENT OF FIBROSIS UNIV BIRMINGHAM (GB) 2023-09-27 EP disclosed
US-20220347125-A1 ANTITUMOR AGENT AND COMPOUNDING AGENT KEIO UNIVERSITY (JP) 2022-11-03 US disclosed
EP-3973991-A1 ANTI-TUMOR AGENT AND COMPOUNDING AGENT Keio University (JP) 2022-03-30 EP disclosed
US-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-08-05 US disclosed
WO-2020230701-A1 ANTITUMOR AGENT AND COMPOUNDING AGENT 学校法人 慶應義塾 2020-11-19 WO disclosed
EP-3632420-A1 TREATMENT OF FIBROSIS The University Of Birmingham (GB) 2020-04-08 EP disclosed
WO-1999034784-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING DISULFIRAM FOR INHIBITING ANGIOGENESIS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1999-07-15 WO disclosed
US-5290834-A Method for controlling elution rate of agent ROHM & HAAS COMPANY (US) 1994-03-01 US disclosed
EP-0042701-B2 ISOCYANATE COMPOSITION Takeda Chemical Industries, Ltd. (JP) 1987-09-16 EP disclosed
EP-0042701-B1 ISOCYANATE COMPOSITION Takeda Chemical Industries, Ltd. (JP) 1984-09-05 EP disclosed
US-4412072-A STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1983-10-25 US disclosed
EP-0042701-A2 Isocyanate composition Takeda Chemical Industries, Ltd. (JP) 1981-12-30 EP 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 (3 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-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ATXN2L, ATXN2, ATXN10 ALDH1A1 4306/4885ALDH2 4145/4885LMNA 1046/4885
US-20220347125-A1 ANTITUMOR AGENT AND COMPOUNDING AGENT GSTA1, GSTP1, GSTA2 ALDH1A1 692/4885ALDH2 195/4885LMNA 4828/4885
US-20070203073-A1 SARS and Ebola inhibitors and use thereof, and methods for their discovery CTSL, CTSV, CTSZ ALDH1A1 2172/4885ALDH2 1855/4885LMNA 812/4885

“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.