SCHEMBL9023561

SCHEMBL9023561

Cc1nc(C(F)(F)C(F)(F)F)cc(=O)[nH]1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
PDE2A O00408 12/20 0.44
GSK3B P49841 1/20 0.41
HPGD P15428 2/20 0.39
FABP4 P15090 1/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL9025674 0.85 HPGD (0.53) SMN1; SMN2PDE2AGSK3BHPGDFABP4
SCHEMBL12986514 0.79 SMN1; SMN2 (0.48) SMN1; SMN2PDE2AGSK3BFABP4
SCHEMBL17926753 0.78 CYP3A4 (0.52) PDE2AHPGDKDM4EPOLB
SCHEMBL11726649 0.69 KDM4E (0.39) SMN1; SMN2PDE2AHPGDFABP4KDM4E
SCHEMBL5935763 0.69
SCHEMBL9392467 0.68 KDM4E (0.31) HPGDKDM4EPOLBMAPT
SCHEMBL2632907 0.66
SCHEMBL11937375 0.66
SCHEMBL13375700 0.66
SCHEMBL7161983 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0611368-B1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSIN II ANTAGONISTS AMERICAN HOME PROD (US) 1996-02-07 EP disclosed
EP-0611368-A1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSINE II ANTAGONISTS. AMERICAN HOME PROD (US) 1994-08-24 EP disclosed
US-5336677-A ANTAGONIST OF ANGIOTENSIN II AMERICAN HOME PRODUCTS CORPORATION (US) 1994-08-09 US disclosed
WO-1993008169-A1 SUBSTITUTED AMINOPYRIMIDINES AS ANGIOTENSINE II ANTAGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-04-29 WO disclosed