SCHEMBL27360548

SCHEMBL27360548

CCCCC(=O)N(Cc1ccc(-c2ccccc2)c(-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)c1)c1ncccc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.41
AGTR2 P50052 2/20 0.38
AGT P01019 2/20 0.37
LTB4R2 Q9NPC1 11/20 0.36
RXFP1 Q9HBX9 1/20 0.35
TP53 P04637 1/20 0.35
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL9854283 0.94 AGTR1 (0.45) AGTR1AGTR2AGTLTB4R2RXFP1
SCHEMBL27362689 0.90 AGTR1 (0.39) AGTR1AGTR2AGTLTB4R2
SCHEMBL9854268 0.83 AGTR1 (0.43) AGTR1AGTR2AGTLTB4R2
SCHEMBL9854287 0.80 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9591475 0.78 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL5180024 0.76 AGTR1 (0.53) AGTR1AGTR2AGTLTB4R2
SCHEMBL29205122 0.74 AGTR1 (0.54) AGTR1AGTR2AGTLTB4R2
SCHEMBL29205124 0.74 AGTR1 (0.54) AGTR1AGTR2AGTLTB4R2
SCHEMBL5789793 0.73 AGTR1 (0.41) AGTR1AGTR2AGTLTB4R2
SCHEMBL9854356 0.72 LTB4R2 (0.48) AGTR1AGTR2LTB4R2RXFP1TP53

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
CN-1051358-A Condensed imdazole derivatives and preparation method thereof FUJISAWA PHARMACEUTICAL CO (JP) 1991-05-15 CN disclosed