SCHEMBL8873487

SCHEMBL8873487

Cc1nc(NCc2ccc(-c3ccccc3C#N)cc2)c(NC(=O)C2CC2)c(C)c1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.47
HTT P42858 1/20 0.42
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 5/20 0.41
HPGD P15428 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
BDKRB1 P46663 3/20 0.41
HSD17B10 Q99714 4/20 0.40
JAK1 P23458 1/20 0.39
MYC P01106 1/20 0.39
WDR5 P61964 1/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
TSHR P16473 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
MAPK1 P28482 2/20 0.38
CYP2C9 P11712 2/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL8873971 0.90 ABL1 (0.47) ABL1HTTALDH1A1KDM4EHPGD
SCHEMBL8872377 0.87 ABL1 (0.49) ABL1ALDH1A1KDM4EHPGDBDKRB1
SCHEMBL8873190 0.85 BDKRB1 (0.45) HTTALDH1A1KDM4EHPGDCRHBP
SCHEMBL8873901 0.84 BDKRB1 (0.50) ALDH1A1KDM4EHPGDCRHBPCRHR2
SCHEMBL8873236 0.84 BDKRB1 (0.45) HTTALDH1A1KDM4EHPGDCRHBP
SCHEMBL8872480 0.83 ABL1 (0.49) ABL1ALDH1A1KDM4EHPGDBDKRB1
SCHEMBL8872934 0.79 ABL1 (0.49) ABL1ALDH1A1KDM4EHSD17B10GSK3A
SCHEMBL8873927 0.75 BDKRB1 (0.45) HTTALDH1A1KDM4EHPGDCRHBP
SCHEMBL8873341 0.74 BDKRB1 (0.50) ALDH1A1KDM4EHPGDCRHBPCRHR2
SCHEMBL8872417 0.73 BDKRB1 (0.45) HTTALDH1A1KDM4EHPGDCRHBP

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