SCHEMBL8873060

SCHEMBL8873060

COC(=O)c1ccccc1-c1ccc(CN(C(=O)C2CC2)c2nc(C)c(Cl)c(C)c2[N+](=O)[O-])cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 5/20 0.42
SLC6A3 Q01959 4/20 0.40
SLC6A4 P31645 3/20 0.40
BDKRB1 P46663 2/20 0.36
CPB1 P15086 1/20 0.35
AGTR1 P30556 1/20 0.35
AGTR2 P50052 1/20 0.35
NR1H4 Q96RI1 3/20 0.35
SLC6A2 P23975 1/20 0.35
BRS3 P32247 1/20 0.34
ACHE P22303 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 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
SCHEMBL8872596 0.91 LTB4R2 (0.42) LTB4R2SLC6A3SLC6A4BDKRB1CPB1
SCHEMBL8872339 0.87 LTB4R2 (0.42) LTB4R2SLC6A3SLC6A4BDKRB1AGTR1
SCHEMBL8872352 0.86 LTB4R2 (0.43) LTB4R2SLC6A3SLC6A4BDKRB1CPB1
SCHEMBL8873132 0.85 LTB4R2 (0.42) LTB4R2SLC6A3SLC6A4BDKRB1AGTR1
SCHEMBL8872708 0.85 OXTR (0.37) CPB1NR1H4KDM4EALDH1A1HPGD
SCHEMBL8873210 0.84 LTB4R2 (0.43) LTB4R2SLC6A3SLC6A4BDKRB1AGTR1
SCHEMBL8958619 0.78 NR1H4 (0.40) NR1H4
SCHEMBL8874430 0.77 LTB4R2 (0.52) LTB4R2SLC6A3BDKRB1AGTR1AGTR2
SCHEMBL8872577 0.76 LTB4R2 (0.59) LTB4R2AGTR1
SCHEMBL8876549 0.76 SLC6A3 (0.39) LTB4R2SLC6A3SLC6A4BDKRB1AGTR1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5700938-A Intermediates for imidazopyridine derivatives EISAI CO., LTD. (JP) 1997-12-23 US disclosed
US-5618969-A Intermediates for imidazopyridines EISAI CO., LTD. (JP) 1997-04-08 US disclosed
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-5559236-A Intermediates for substituted biphenylmethylmidazopyridine angiotensin II antagonists EISAI CO., LTD. (JP) 1996-09-24 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