SCHEMBL9145258

SCHEMBL9145258

CCCCc1nn(-c2ccc(NC(=O)CC)cc2C(F)(F)F)c(=O)n1Cc1ccc(-c2ccccc2S(=O)(=O)NC(=O)c2ccccc2Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.78
AGTR2 P50052 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
SCHEMBL9146433 0.95 AGTR1 (0.86) AGTR1AGTR2
SCHEMBL9146382 0.91 AGTR1 (0.83) AGTR1AGTR2
SCHEMBL9148361 0.91
SCHEMBL9565988 0.91 AGTR1 (0.79) AGTR1AGTR2
SCHEMBL9565979 0.91 AGTR1 (0.79) AGTR1AGTR2
SCHEMBL9142437 0.90
SCHEMBL9565999 0.90 AGTR1 (0.83) AGTR1
SCHEMBL9373638 0.89 AGTR2 (0.90) AGTR1AGTR2
SCHEMBL9145885 0.88
SCHEMBL9143211 0.88 AGTR2 (1.00) 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
US-5411980-A Substituted triazolinones, triazolinethiones, and triazolinimines as angiotensin II antagonists MERCK & CO., INC. (US) 1995-05-02 US disclosed
EP-0526001-A1 Substituted triazolinones MERCK & CO. INC. (US) 1993-02-03 EP disclosed
WO-1993001177-A1 SUBSTITUTED TRIAZOLINONES MERCK & CO., INC. (US) 1993-01-21 WO disclosed