SCHEMBL8879293

SCHEMBL8879293

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

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.38
BDKRB1 P46663 12/20 0.36
BRS3 P32247 1/20 0.35
SLC6A4 P31645 3/20 0.35
LTB4R2 Q9NPC1 1/20 0.34
SLC6A2 P23975 1/20 0.34
ACHE P22303 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL8876549 0.91 SLC6A3 (0.39) SLC6A3BDKRB1SLC6A4LTB4R2SLC6A2
SCHEMBL8873195 0.88 BDKRB1 (0.39) SLC6A3BDKRB1BRS3SLC6A4LTB4R2
SCHEMBL8873694 0.86 LMNA (0.35) ALDH1A1
SCHEMBL8877456 0.86 BDKRB1 (0.39) SLC6A3BDKRB1BRS3SLC6A4LTB4R2
SCHEMBL8879710 0.84 BDKRB1 (0.39) SLC6A3BDKRB1BRS3SLC6A4LTB4R2
SCHEMBL8873630 0.83 BDKRB1 (0.47) SLC6A3BDKRB1BRS3SLC6A4
SCHEMBL8878811 0.79 BDKRB1 (0.40) SLC6A3BDKRB1BRS3SLC6A4LTB4R2
SCHEMBL8877960 0.78 BDKRB1 (0.39) SLC6A3BDKRB1BRS3SLC6A4LTB4R2
SCHEMBL8872711 0.77 LMNA (0.35) ACHEALDH1A1
SCHEMBL8873138 0.76 SLC6A3 (0.39) SLC6A3BDKRB1BRS3SLC6A4SLC6A2

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 5 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-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