SCHEMBL3522966

SCHEMBL3522966

Cc1nc(OCc2ccc(F)cc2F)c(Cl)c(=O)n1-c1ccc2c(c1)CN(S(C)(=O)=O)CC2

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.43
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
MAPK11 Q15759 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
MAPKAPK2 P49137 2/20 0.37
ATM Q13315 1/20 0.37
GPR6 P46095 1/20 0.36

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
SCHEMBL3520357 0.97 MAPK14 (0.43) MAPK14ESR1ESR2MAPK11MAPKAPK2
SCHEMBL3525542 0.94 MAPK14 (0.43) MAPK14MAPK11MAPKAPK2
SCHEMBL3518939 0.87 MAPK14 (0.42) MAPK14MAPK11MAPKAPK2
SCHEMBL3522819 0.86 MAPK14 (0.44) MAPK14MAPK11MAPKAPK2
SCHEMBL3521119 0.85 MAPK14 (0.42) MAPK14MAPK11MAPKAPK2
SCHEMBL4467028 0.85 MAPK14 (0.59) MAPK14MAPKAPK2
SCHEMBL3522866 0.84 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL3523146 0.84 MAPK14 (0.40) MAPK14ESR1ESR2MAPK11MAPKAPK2
SCHEMBL3522997 0.84 MAPK14 (0.43) MAPK14MAPK11MAPKAPK2
SCHEMBL3522006 0.84 MAPK14 (0.42) MAPK14MAPK11MAPKAPK2

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
US-7795271-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2010-09-14 US disclosed
US-20090306108-A1 SUBSTITUTED PYRIMIDINONES PFIZER INC 2009-12-10 US disclosed
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES PHARMACIA CORPORATION (US) 2007-07-19 US disclosed
US-7183287-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2007-02-27 US disclosed
US-20040242608-A1 Substituted pyrimidinones PHARMACIA LLC 2004-12-02 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 (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-20090306108-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885ESR1 2631/4885ESR2 2057/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885ESR1 3864/4885ESR2 2025/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885ESR1 2631/4885ESR2 2057/4885

“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.