SCHEMBL9856412

SCHEMBL9856412

CCCCc1nc(Cl)c(C(=O)N(C)C)n1Cc1ccc(-c2ccccc2)c(C(=O)O)c1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.60
AGTR1 P30556 3/20 0.60

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
SCHEMBL8954213 0.91 AGTR1 (0.73) AGTR2AGTR1
SCHEMBL10589434 0.85 AGTR1 (0.82) AGTR2AGTR1
SCHEMBL8735381 0.83 AGTR1 (0.68) AGTR2AGTR1
SCHEMBL27367431 0.82 AGTR1 (0.57) AGTR2AGTR1
SCHEMBL708 0.82 AGTR1 (0.80) AGTR2AGTR1
SCHEMBL8076001 0.81 AGTR1 (0.65) AGTR2AGTR1
SCHEMBL9468705 0.81 AGTR1 (0.78) AGTR2AGTR1
SCHEMBL29726833 0.80 AGTR2 (0.66) AGTR2AGTR1
SCHEMBL21083640 0.80 AGTR2 (0.66) AGTR2AGTR1
SCHEMBL27445811 0.80 AGTR1 (0.54) AGTR2AGTR1

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
EP-0437103-A2 Substituted 5-(alkyl)carboxamide imidazoles SMITHKLINE BEECHAM CORPORATION (US) 1991-07-17 EP disclosed