SCHEMBL7123618

SCHEMBL7123618

CC(C)(O)c1cnc(-c2cc3nccc(Cl)c3s2)s1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.32
GCK P35557 1/20 0.31
GCKR Q14397 1/20 0.31
CCND1 P24385 2/20 0.31
CDK6 Q00534 1/20 0.31
CDK4 P11802 1/20 0.31
STK17B O94768 1/20 0.30

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
SCHEMBL7127531 0.80 MCHR1 (0.31) MCHR1CCND1CDK6CDK4
SCHEMBL4707651 0.78 KDM4E (0.32) MCHR1
SCHEMBL7122716 0.77 MCHR1 (0.33) MCHR1CCND1CDK6CDK4
SCHEMBL7125950 0.72 MCHR1 (0.35) MCHR1STK17B
SCHEMBL3568952 0.72 ADORA2A (0.42)
SCHEMBL5241545 0.72 MCHR1 (0.31) MCHR1
SCHEMBL7671297 0.71 MCHR1 (0.33) MCHR1GCKGCKR
SCHEMBL23911405 0.70 PDPK1 (0.33) GCKGCKR
SCHEMBL5245169 0.70 PDPK1 (0.36)
SCHEMBL5242158 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101328186-A Thienopyrimidine and thienopyridine derivatives useful as anticancer agents PFIZER PROD INC (US) 2008-12-24 CN disclosed
US-20030162795-A1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents PFIZER INC. 2003-08-28 US disclosed
US-6492383-B1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents PFIZER INC. 2002-12-10 US disclosed
EP-1028964-A1 THIENOPYRIMIDINE AND THIENOPYRIDINE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2000-08-23 EP disclosed
WO-1999024440-A1 THIENOPYRIMIDINE AND THIENOPYRIDINE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 1999-05-20 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-20030162795-A1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents TYMP, DPYD, HPRT1 MCHR1 3278/4885GCK 1175/4885GCKR 1837/4885

“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.