SCHEMBL5149907

SCHEMBL5149907

Nc1csc(S(N)(=O)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 19/20 0.52
CA1 P00915 3/20 0.45
CA4 P22748 1/20 0.45
CA7 P43166 1/20 0.45
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
CDK5 Q00535 1/20 0.39
CDK5R1 Q15078 1/20 0.39

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
SCHEMBL5155290 0.79 GCK (0.37) CA2CA1CA4CA7
SCHEMBL8122844 0.79 ALDH1A1 (0.38) CA2
SCHEMBL2008068 0.76 CA2 (0.52) CA2CA1CA4CA7CA12
SCHEMBL28047295 0.76 CA2 (0.59) CA2
SCHEMBL23531742 0.74 CA2 (0.50) CA2CA1CA4CA7CA12
SCHEMBL28189287 0.74 CA2 (0.50) CA2CA1CA4CA7CA12
SCHEMBL2009694 0.74 CA2 (0.58) CA2CA1CA12CA9CCNE1
SCHEMBL4645608 0.74 CA2 (0.50) CA2CA1CA4CA7CA12
SCHEMBL14336418 0.74 CA2 (0.34) CA2CA1CA4CA7CA12
SCHEMBL27452903 0.71 CA2 (0.53) CA2CA1CA4CA7CA12

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105237523-B Pyrimidine derivatives and preparation method thereof, purposes 深圳市博圣康生物科技有限公司 2018-06-01 CN claimed
CN-105237523-A Pyrimidine derivatives, and preparation method and use thereof SHENZHEN BIOSCIEN PHARMACEUTICALS CO LTD 2016-01-13 CN claimed
CN-119585247-A Bicyclic heterocyclic amide inhibitors of nav1.8 for the treatment of pain 赛特温治疗公司 2025-03-07 CN disclosed
EP-4514789-A1 <SUP2/>? <SUB2/>?V?BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA1.8 FOR THE TREATMENT OF PAIN SiteOne Therapeutics, Inc. (US) 2025-03-05 EP disclosed
WO-2023211990-A1 BICYCLIC HETEROCYCLIC AMIDE INHIBITORS OF NA V1.8 FOR THE TREATMENT OF PAIN SITEONE THERAPEUTICS, INC. (US) 2023-11-02 WO disclosed
CN-105237523-B Pyrimidine derivatives and preparation method thereof, purposes 深圳市博圣康生物科技有限公司 2018-06-01 CN disclosed
CN-105237523-A Pyrimidine derivatives, and preparation method and use thereof SHENZHEN BIOSCIEN PHARMACEUTICALS CO LTD 2016-01-13 CN disclosed
US-7288547-B2 CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents SCHERING AG (DE) 2007-10-30 US disclosed
US-7288547-B2 CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents SCHERING AG (DE) 2007-10-30 US disclosed
US-7288547-B2 CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents SCHERING AG (DE) 2007-10-30 US disclosed
EP-1483260-A1 CDK INHIBITING 2-HETEROARYL PYRIMIDINE, THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT Schering Aktiengesellschaft (DE) 2004-12-08 EP disclosed
US-20040063737-A1 CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents SCHERING AG (DE) 2004-04-01 US disclosed
WO-2003076437-A1 CDK INHIBITING 2-HETEROARYL PYRIMIDINE, THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT SCHERING AKTIENGESELLSCHAFT (DE) 2003-09-18 WO 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 (1 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-20040063737-A1 CDK-inhibitory 2-heteroaryl-pyrimidines, their production and use as pharmaceutical agents CDK2, CDK6, CDKL2 CA2 3633/4885CA1 4738/4885CA4 4451/4885

“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.