SCHEMBL8875663

SCHEMBL8875663

CCC(Cc1ccc(-c2ccccc2C#N)cc1)C(=O)Nc1nccc(C)c1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 5/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
MME P08473 1/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
PTPN1 P18031 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ITGB1 P05556 1/20 0.37
ITGA4 P13612 1/20 0.37
FFAR1 O14842 1/20 0.36
AKR1B1 P15121 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MYC P01106 1/20 0.35
WDR5 P61964 1/20 0.35

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
SCHEMBL8872821 0.93 BDKRB1 (0.39) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL8873500 0.87 MME (0.38) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL8872016 0.86 MME (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8873617 0.86 MME (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8878240 0.85 BDKRB1 (0.50) BDKRB1
SCHEMBL8873067 0.83 MME (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8872885 0.83 MME (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL9088594 0.81 L3MBTL1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL8873275 0.81 MME (0.37) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL8873003 0.80 MME (0.36) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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