SCHEMBL8872985

SCHEMBL8872985

Cc1cc(C)c([N+](=O)[O-])c(NC(=O)C2CC2Cc2ccc(-c3ccccc3C#N)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.37
MYC P01106 1/20 0.35
WDR5 P61964 1/20 0.35
MAP4K1 Q92918 5/20 0.35
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
ADAM17 P78536 1/20 0.34
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
KLKB1 P03952 1/20 0.33
OXTR P30559 1/20 0.33
AVPR1A P37288 1/20 0.33
TP53 P04637 1/20 0.33
SRC P12931 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
GRM5 P41594 1/20 0.33
CTSS P25774 1/20 0.32
BDKRB1 P46663 1/20 0.32

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
SCHEMBL8874542 0.88 BDKRB1 (0.39) ABL1MYCWDR5MAP4K1ITGB1
SCHEMBL8872711 0.86 LMNA (0.35) ABL1MYCWDR5ITGB1ITGA4
SCHEMBL8873694 0.86 LMNA (0.35) ABL1MYCWDR5MAP4K1ITGB1
SCHEMBL8949946 0.85 ABL1 (0.39) ABL1MYCWDR5MAP4K1ITGB1
SCHEMBL8877456 0.85 BDKRB1 (0.39) BDKRB1
SCHEMBL8872200 0.83 ABL1 (0.38) ABL1MYCWDR5MAP4K1ITGB1
SCHEMBL8872938 0.83 ABL1 (0.38) ABL1MYCWDR5MAP4K1ITGB1
SCHEMBL8873500 0.79 MME (0.38) MYCWDR5ITGB1ITGA4GSK3A
SCHEMBL8958623 0.78 LMNA (0.36) MAP4K1GSK3AGSK3BTP53KDM4E
SCHEMBL8958497 0.78 LMNA (0.36) MAP4K1GSK3AGSK3BTP53KDM4E

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