SCHEMBL8116334

SCHEMBL8116334

CCCc1cn(-c2c(F)cccc2C(C)C)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cn1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.45
AGTR2 P50052 8/20 0.45
USP1 O94782 1/20 0.31

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
SCHEMBL8107742 0.96 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL8115877 0.95 AGTR1 (0.49) AGTR1AGTR2USP1
SCHEMBL8117467 0.93 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL8109347 0.93 AGTR1 (0.46) AGTR1AGTR2USP1
SCHEMBL8117706 0.92 AGTR1 (0.45) AGTR1AGTR2USP1
SCHEMBL8115594 0.92 AGTR1 (0.45) AGTR1AGTR2USP1
SCHEMBL8116072 0.91 AGTR1 (0.45) AGTR1AGTR2USP1
SCHEMBL8118127 0.91 AGTR1 (0.45) AGTR1AGTR2USP1
SCHEMBL8107194 0.91 AGTR1 (0.45) AGTR1AGTR2USP1
SCHEMBL8116940 0.91 AGTR1 (0.44) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664802-B1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS SEARLE & CO (US) 2000-03-15 EP disclosed
EP-0664802-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1995-08-02 EP disclosed
WO-1994008990-A1 N-ARYLHETEROARYLALKYL 1-PHENYL-IMIDAZOL-2-ONE COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1994-04-28 WO disclosed