SCHEMBL8873190

SCHEMBL8873190

CCCC(=O)Nc1c(NCc2ccc(-c3ccccc3C#N)cc2)nc(C)c(Br)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 7/20 0.45
HTT P42858 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 4/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 3/20 0.40
TSHR P16473 3/20 0.40
CYP2C9 P11712 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C19 P33261 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
CLK4 Q9HAZ1 1/20 0.40

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
SCHEMBL8873236 0.95 BDKRB1 (0.45) BDKRB1HTTALDH1A1KDM4EHSD17B10
SCHEMBL8873927 0.90 BDKRB1 (0.45) BDKRB1HTTALDH1A1KDM4EHSD17B10
SCHEMBL8872064 0.87 BDKRB1 (0.47) BDKRB1HTTALDH1A1KDM4EHSD17B10
SCHEMBL8873487 0.85 ABL1 (0.47) BDKRB1HTTALDH1A1KDM4EHSD17B10
SCHEMBL8872417 0.84 BDKRB1 (0.45) BDKRB1HTTALDH1A1KDM4EHSD17B10
SCHEMBL8872714 0.84 BDKRB1 (0.63) BDKRB1ALDH1A1KDM4EHPGDCRHBP
SCHEMBL8872882 0.83 BDKRB1 (0.47) BDKRB1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL8874313 0.82 BDKRB1 (0.47) BDKRB1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL8874082 0.79 BDKRB1 (0.64) BDKRB1ALDH1A1KDM4EHPGDCRHBP
SCHEMBL8872963 0.78 BDKRB1 (0.47) BDKRB1ALDH1A1KDM4EHSD17B10HPGD

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