SCHEMBL8876549

SCHEMBL8876549

COC(=O)c1ccccc1-c1ccc(CC2CC2C(=O)Nc2nc(C)c(Cl)c(C)c2[N+](=O)[O-])cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.39
SLC6A4 P31645 3/20 0.39
BDKRB1 P46663 11/20 0.36
ACHE P22303 1/20 0.35
AGTR1 P30556 1/20 0.34
AGTR2 P50052 1/20 0.34
LTB4R2 Q9NPC1 2/20 0.34
SLC6A2 P23975 1/20 0.34
LTB4R Q15722 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
SCHEMBL8879293 0.91 SLC6A3 (0.38) SLC6A3SLC6A4BDKRB1ACHELTB4R2
SCHEMBL8879710 0.88 BDKRB1 (0.39) SLC6A3SLC6A4BDKRB1ACHEAGTR1
SCHEMBL8872711 0.86 LMNA (0.35) ACHE
SCHEMBL8877456 0.86 BDKRB1 (0.39) SLC6A3SLC6A4BDKRB1LTB4R2SLC6A2
SCHEMBL8873195 0.84 BDKRB1 (0.39) SLC6A3SLC6A4BDKRB1ACHEAGTR1
SCHEMBL8873630 0.83 BDKRB1 (0.47) SLC6A3SLC6A4BDKRB1
SCHEMBL8958623 0.80 LMNA (0.36)
SCHEMBL8872353 0.76 SLC6A3 (0.40) SLC6A3SLC6A4BDKRB1AGTR1AGTR2
SCHEMBL8873060 0.76 LTB4R2 (0.42) SLC6A3SLC6A4BDKRB1ACHEAGTR1
SCHEMBL8872985 0.71 ABL1 (0.37) BDKRB1

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