SCHEMBL3520571

SCHEMBL3520571

CNCC(=O)N1CCc2cc(-n3c(C)nc(OCc4ccc(F)cc4F)c(Cl)c3=O)ccc2C1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.42
MAPK11 Q15759 3/20 0.41
CDK4 P11802 2/20 0.37
CDK2 P24941 2/20 0.37
CDK6 Q00534 2/20 0.37
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
CDK1 P06493 1/20 0.36
CDK7 P50613 1/20 0.36
CDK9 P50750 1/20 0.36
ROCK2 O75116 1/20 0.36
MAPK12 P53778 1/20 0.36
STRADA Q7RTN6 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
SCHEMBL3522866 0.97 MAPK14 (0.42) MAPK14MAPK11CDK4CDK2CDK6
SCHEMBL3527574 0.94 MAPK14 (0.44) MAPK14MAPK11ROCK2MAPK12STRADA
SCHEMBL3523569 0.92 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL3526966 0.91 MAPK14 (0.43) MAPK14MAPK11CDK4CDK2CDK6
SCHEMBL3522006 0.91 MAPK14 (0.42) MAPK14MAPK11GABRG2GABRB3GABRA5
SCHEMBL3518549 0.90 MAPK14 (0.44) MAPK14MAPK11
SCHEMBL3522815 0.90 MAPK14 (0.39) MAPK14MAPK11
SCHEMBL3521119 0.89 MAPK14 (0.42) MAPK14MAPK11
SCHEMBL3522997 0.88 MAPK14 (0.43) MAPK14MAPK11CDK4CDK2CDK6
SCHEMBL3520861 0.88 MAPK14 (0.40) MAPK14MAPK11

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 38/4885MAPK11 43/4885CDK4 410/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 MAPK14 29/4885MAPK11 48/4885CDK4 563/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 MAPK14 38/4885MAPK11 43/4885CDK4 410/4885

“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.