SCHEMBL9308894

SCHEMBL9308894

CCCc1nc(COC)n2[nH]c(=O)nc2c1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.53
PPARG P37231 2/20 0.43

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
SCHEMBL9309558 0.91 AGTR1 (0.56) AGTR1PPARG
SCHEMBL9308944 0.87 AGTR1 (0.69) AGTR1PPARG
SCHEMBL9308846 0.84 PPARG (0.42) AGTR1PPARG
SCHEMBL9310969 0.82 AGTR1 (0.57) AGTR1
SCHEMBL9308892 0.81 AGTR1 (0.62) AGTR1
SCHEMBL9309641 0.79 AGTR1 (0.48) AGTR1PPARG
SCHEMBL9308412 0.79 AGTR1 (0.58) AGTR1PPARG
SCHEMBL9308255 0.77 PPARG (0.46) AGTR1PPARG
SCHEMBL4011221 0.77 PPARG (0.43) AGTR1PPARG
SCHEMBL1893587 0.76 PPARG (0.48) PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5358950-A Useful in treatment of cardiovascular diseases LABORATOIRES UPSA (FR) 1994-10-25 US disclosed