SCHEMBL2606775

SCHEMBL2606775

CC(C)NC1CCS(=O)(=O)C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
MAPT P10636 1/20 0.52
POLB P06746 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.48
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL26718859 1.00 ALDH1A1 (0.52) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL15498659 0.89 POLB (0.43) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL8224831 0.86 ALDH1A1 (0.41) ALDH1A1MAPTPOLBSMN1; SMN2GAA
Hydrochloric Acid SCHEMBL11206123 0.82 ALDH1A1 (0.52) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL21661624 0.81 POLB (0.38) ALDH1A1MAPTPOLBSMN1; SMN2
SCHEMBL11197967 0.80 ALDH1A1 (0.47) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL20988155 0.78 ALDH1A1 (0.48) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL11813285 0.77 ALDH1A1 (0.47) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL14673052 0.76 POLB (0.50) ALDH1A1MAPTPOLBSMN1; SMN2GAA
SCHEMBL21870591 0.75 ALDH1A1 (0.48) ALDH1A1MAPTPOLBSMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159498-A1 SMALL MOLECULES FOR THE TREATMENT OF AUTOIMMUNE DISEASES AND CANCER ATHOS THERAPEUTICS, INC. 2023-05-25 US disclosed
US-11141406-B2 Pharmaceutical compounds ReViral Limited (GB) 2021-10-12 US disclosed
US-11078189-B2 Pharmaceutical compounds ReViral Limited (GB) 2021-08-03 US disclosed
US-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2021-02-18 US disclosed
US-10829490-B2 Substituted dihydropyrazino[1 ′,2′:1,5]pyrrolo[2,3-d]pyrimidine-based antiproliferative agents GI Therapeutics, Inc. (US) 2020-11-10 US disclosed
US-20200331925-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ABNORMAL CELLULAR PROLIFERATION G1 THERAPEUTICS, INC. (US) 2020-10-22 US disclosed
US-20200316030-A1 PHARMACEUTICAL COMPOUNDS SILICON VALLEY BANK 2020-10-08 US disclosed
US-20200239486-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER G1 THERAPEUTICS, INC. (US) 2020-07-30 US disclosed
US-20200172515-A1 PHARMACEUTICAL COMPOUNDS SILICON VALLEY BANK 2020-06-04 US disclosed
US-20190135811-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2019-05-09 US disclosed
US-20110059943-A1 JAK2 INHIBITORS AND THEIR USE FOR THE TREATMENT OF MYELOPROLIFERATIVE DISEASES AND CANCER BRISTOL-MYERS SQUIBB COMPANY 2011-03-10 US disclosed
US-7888363-B2 1-Cyclopentyl-3-methyl-2-(2-pyridyl)indole-5-amino/thio/carbonyl derivatives; hepatitis C virus infection; synergistic with another inhibitor of HCV polymerase or immunomodulatory agent such as interferons BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-15 US disclosed
US-7888363-B2 1-Cyclopentyl-3-methyl-2-(2-pyridyl)indole-5-amino/thio/carbonyl derivatives; hepatitis C virus infection; synergistic with another inhibitor of HCV polymerase or immunomodulatory agent such as interferons BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-15 US disclosed
US-7691879-B2 Isoquinoline potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2010-04-06 US disclosed
US-20070142380-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-21 US disclosed
US-20070142380-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-21 US disclosed
US-7223785-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-05-29 US disclosed
US-4374040-A ANTICORROSION, ANTISCALE, ANTIDERPOSIT BUCKMAN LABORATORIES, INC. (US) 1983-02-15 US disclosed
US-4243524-A ANTISCALING, ANTISLUDGING BUCKMAN LABORATORIES, INC. (US) 1981-01-06 US disclosed
US-4181806-A ANTISLUDGING AGENTS, ANTISCALING AGENTS BUCKMAN LABORATORIES, INC. (US) 1980-01-01 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 (12 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-20190135811-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS TYMP, TYMS, DPYD ALDH1A1 1403/4885MAPT 3991/4885POLB 81/4885
US-11141406-B2 Pharmaceutical compounds CBR3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1 ALDH1A1 3355/4885MAPT 4010/4885POLB 2709/4885
US-20210047328-A1 PYRIMIDINE-BASED ANTIPROLIFERATIVE AGENTS TYMP, TYMS, DPYD ALDH1A1 1403/4885MAPT 3991/4885POLB 81/4885
US-20110059943-A1 JAK2 INHIBITORS AND THEIR USE FOR THE TREATMENT OF MYELOPROLIFERATIVE DISEASES AND CANCER JAK2, JAK1, JAK3 ALDH1A1 2563/4885MAPT 4836/4885POLB 2432/4885
US-20230159498-A1 SMALL MOLECULES FOR THE TREATMENT OF AUTOIMMUNE DISEASES AND CANCER SSB, HLA-DRB1, UACA ALDH1A1 3670/4885MAPT 4698/4885POLB 1646/4885
US-20200316030-A1 PHARMACEUTICAL COMPOUNDS CBR3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1 ALDH1A1 3435/4885MAPT 4099/4885POLB 2798/4885
US-10829490-B2 Substituted dihydropyrazino[1 ′,2′:1,5]pyrrolo[2,3-d]pyrimidine-based antiproliferative agents MKI67, DPYD, PCNA ALDH1A1 574/4885MAPT 4144/4885POLB 132/4885
US-11078189-B2 Pharmaceutical compounds HRH4, CHRM5, CHRM1 ALDH1A1 3367/4885MAPT 3311/4885POLB 3491/4885
US-20200239486-A1 PYRIMIDINE-BASED COMPOUNDS FOR THE TREATMENT OF CANCER TYMS, TYMP, DPYD ALDH1A1 911/4885MAPT 3328/4885POLB 76/4885
US-20070142380-A1 Viral Polymerase Inhibitors POLM, POLR2H, POLR2A ALDH1A1 1556/4885MAPT 45/4885POLB 9/4885
US-20200172515-A1 PHARMACEUTICAL COMPOUNDS HRH4, CHRM5, CHRM1 ALDH1A1 3367/4885MAPT 3311/4885POLB 3491/4885
US-20200331925-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF ABNORMAL CELLULAR PROLIFERATION MKI67, CCNC, CCNI ALDH1A1 1348/4885MAPT 3455/4885POLB 894/4885

“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.