SCHEMBL8879710

SCHEMBL8879710

COC(=O)c1ccccc1-c1ccc(CC2CC2C(=O)Nc2ncc(Cl)c(C)c2[N+](=O)[O-])cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 12/20 0.39
SLC6A3 Q01959 3/20 0.39
SLC6A4 P31645 2/20 0.39
BRS3 P32247 2/20 0.37
ACHE P22303 1/20 0.35
AGTR1 P30556 1/20 0.34
AGTR2 P50052 1/20 0.34
LTB4R2 Q9NPC1 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
SCHEMBL8873195 0.91 BDKRB1 (0.39) BDKRB1SLC6A3SLC6A4BRS3ACHE
SCHEMBL8876549 0.88 SLC6A3 (0.39) BDKRB1SLC6A3SLC6A4ACHEAGTR1
SCHEMBL8873630 0.86 BDKRB1 (0.47) BDKRB1SLC6A3SLC6A4BRS3
SCHEMBL8872200 0.86 ABL1 (0.38)
SCHEMBL8879293 0.84 SLC6A3 (0.38) BDKRB1SLC6A3SLC6A4BRS3ACHE
SCHEMBL8877456 0.83 BDKRB1 (0.39) BDKRB1SLC6A3SLC6A4BRS3LTB4R2
SCHEMBL8958444 0.80 WNT3A (0.37)
SCHEMBL8949946 0.78 ABL1 (0.39) BDKRB1
SCHEMBL8872339 0.78 LTB4R2 (0.42) BDKRB1SLC6A3SLC6A4BRS3AGTR1
SCHEMBL8872938 0.77 ABL1 (0.38)

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