SCHEMBL8877960

SCHEMBL8877960

CCCC(Cc1ccc(-c2ccccc2C(=O)OC)cc1)C(=O)Nc1nc(C)c(Br)c(C)c1[N+](=O)[O-]

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.39
SLC6A3 Q01959 4/20 0.38
AGTR1 P30556 1/20 0.38
AGTR2 P50052 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
BRS3 P32247 1/20 0.37
SLC6A4 P31645 3/20 0.35
SLC6A2 P23975 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
SCHEMBL8878811 0.94 BDKRB1 (0.40) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8873987 0.88 BDKRB1 (0.41) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8872477 0.86 MME (0.36) AGTR1AGTR2
SCHEMBL8876246 0.86 BDKRB1 (0.40) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8880408 0.83 BDKRB1 (0.47) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8877163 0.81 BDKRB1 (0.42) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8872885 0.79 MME (0.37)
SCHEMBL8878462 0.79 BDKRB1 (0.42) BDKRB1SLC6A3AGTR1AGTR2LTB4R2
SCHEMBL8879293 0.78 SLC6A3 (0.38) BDKRB1SLC6A3LTB4R2BRS3SLC6A4
SCHEMBL8872452 0.77 MME (0.36) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5608068-A Process for the preparation of imidazopyridine derivatives and intermediates EISAI CO., LTD. (JP) 1997-03-04 US disclosed
US-5587504-A Sulfonyloxy-biphenylcarboxylic ester derivatives which are intermediates EISAI CO., LTD. (JP) 1996-12-24 US disclosed
US-5583229-A Process for the preparation of imidazopyridine derivatives EISAI CO., LTD. (JP) 1996-12-10 US disclosed
US-5557002-A Process for the preparation of biphenyl containing intermediates useful in making angiotensin II receptor antagonists EISAI CO., LTD. (JP) 1996-09-17 US disclosed
US-5554757-A Process for the preparation of imidazopyridine derivatives, and intermediates therefore EISAI CO., LTD. (JP) 1996-09-10 US disclosed
EP-0627433-A1 PROCESS FOR PRODUCING IMIDAZOPYRIDINE DERIVATIVE AND INTERMEDIATE Eisai Co., Ltd. (JP) 1994-12-07 EP disclosed