SCHEMBL9706004

SCHEMBL9706004

CCCCC1=C(C)N(C(=O)Cc2ccccc2)CN1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.38
AGTR2 P50052 5/20 0.38
PPARG P37231 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
SCHEMBL9705468 0.90 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9705057 0.84 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL9531428 0.84 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL9530228 0.83 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL9705135 0.82 AGTR1 (0.38) AGTR1AGTR2PPARG
SCHEMBL9533771 0.81 AGTR1 (0.37) AGTR1AGTR2PPARG
SCHEMBL9706077 0.81 AGTR1 (0.37) AGTR1AGTR2PPARG
SCHEMBL9532898 0.80 AGTR1 (0.35) AGTR1AGTR2
SCHEMBL9530975 0.79 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL9535319 0.79 AGTR1 (0.35) AGTR1AGTR2

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
WO-1992007834-A1 N-SUBSTITUTED IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1992-05-14 WO disclosed