SCHEMBL9566020

SCHEMBL9566020

CCCCc1nn(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2occ(Cl)c2Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.78

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
SCHEMBL9604297 0.93 AGTR1 (0.69) AGTR1
SCHEMBL9145126 0.91 AGTR1 (0.79) AGTR1
SCHEMBL9565930 0.90 AGTR1 (0.79) AGTR1
SCHEMBL9565990 0.89 AGTR1 (0.84) AGTR1
SCHEMBL9565909 0.89 AGTR1 (0.77) AGTR1
SCHEMBL9565894 0.89 AGTR1 (0.79) AGTR1
SCHEMBL9565999 0.89 AGTR1 (0.83) AGTR1
SCHEMBL9565943 0.88 AGTR1 (0.76) AGTR1
SCHEMBL9566075 0.88 AGTR1 (0.78) AGTR1
SCHEMBL9565903 0.88 AGTR1 (0.82) AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0526001-A1 Substituted triazolinones MERCK & CO. INC. (US) 1993-02-03 EP claimed
EP-0526001-A1 Substituted triazolinones MERCK & CO. INC. (US) 1993-02-03 EP disclosed