SCHEMBL3522722

SCHEMBL3522722

Cc1nc(OCc2ccc(F)cc2F)c(Cl)c(=O)n1-c1ccc2c(c1)N(C(=O)C(C)(C)O)CN2C(=O)CC(C)(C)O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 2/20 0.39
MAPK14 Q16539 16/20 0.38
MAPK11 Q15759 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPKAPK5 Q8IW41 1/20 0.38
PTGER1 P34995 2/20 0.35

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
SCHEMBL3522709 0.95 MAPKAPK2 (0.42) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3526472 0.93 MAPK14 (0.40) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3519715 0.93 MAPK14 (0.40) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3525562 0.93 MAPK14 (0.40) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3525169 0.93 MAPK14 (0.40) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3520586 0.93 MAPK14 (0.41) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3521261 0.93 MAPK14 (0.41) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3526860 0.92 MAPK14 (0.41) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3527059 0.92 MAPK14 (0.41) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5
SCHEMBL3525692 0.92 MAPK14 (0.40) MAPKAPK2MAPK14MAPK11MAPK1MAPKAPK5

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 MAPKAPK2 30/4885MAPK14 38/4885MAPK11 43/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPKAPK2 22/4885MAPK14 29/4885MAPK11 48/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPKAPK2 30/4885MAPK14 38/4885MAPK11 43/4885

“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.