SCHEMBL9252048

SCHEMBL9252048

CCCC1=NC(=O)C(C)(C)N1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.41
LTB4R2 Q9NPC1 4/20 0.41
AGTR2 P50052 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
SCHEMBL9541024 0.96 AGTR1 (0.47) AGTR1LTB4R2AGTR2
SCHEMBL9248296 0.94 AGTR1 (0.48) AGTR1LTB4R2AGTR2
SCHEMBL9257314 0.87 AGTR1 (0.40) AGTR1LTB4R2AGTR2
SCHEMBL9257585 0.86 AGTR1 (0.41) AGTR1LTB4R2AGTR2
SCHEMBL9258021 0.86 AGTR1 (0.34) AGTR1LTB4R2AGTR2
SCHEMBL9258027 0.82 AGTR1 (0.35) AGTR1LTB4R2AGTR2
SCHEMBL9258009 0.82 AGTR1 (0.35) AGTR1LTB4R2AGTR2
SCHEMBL9671801 0.80 AGTR1 (0.64) AGTR1LTB4R2AGTR2
SCHEMBL9366716 0.78 AGTR1 (0.31) AGTR1LTB4R2
SCHEMBL9672263 0.78 AGTR1 (0.51) AGTR1LTB4R2AGTR2

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-0599999-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLINONE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-06-08 EP claimed
WO-1993004045-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLINONE DERIVATIVES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-03-04 WO claimed
US-5424450-A Angiotensin II receptor blocking imidazolinone derivatives E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-06-13 US disclosed