SCHEMBL8872200

SCHEMBL8872200

Cc1c(Cl)cnc(NC(=O)C2CC2Cc2ccc(-c3ccccc3C#N)cc2)c1[N+](=O)[O-]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.38
FPR1 P21462 1/20 0.35
FPR2 P25090 1/20 0.35
CTSA P10619 1/20 0.34
BCL2 P10415 1/20 0.34
MCL1 Q07820 1/20 0.34
SRC P12931 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
ADAM17 P78536 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
MAP4K1 Q92918 5/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
MYC P01106 1/20 0.33
WDR5 P61964 1/20 0.33
RORC P51449 1/20 0.33
FFAR1 O14842 1/20 0.33
AKR1B1 P15121 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL8949946 0.92 ABL1 (0.39) ABL1FPR1FPR2SRCEGLN1
SCHEMBL8958444 0.91 WNT3A (0.37) ABL1CTSABCL2MCL1MAP4K1
SCHEMBL8872938 0.91 ABL1 (0.38) ABL1FPR1FPR2BCL2MCL1
SCHEMBL8872711 0.88 LMNA (0.35) ABL1FPR1FPR2BCL2MCL1
SCHEMBL8874542 0.86 BDKRB1 (0.39) ABL1SRCADAM17ITGB1ITGA4
SCHEMBL8879710 0.86 BDKRB1 (0.39)
SCHEMBL8873694 0.84 LMNA (0.35) ABL1FPR1FPR2BCL2MCL1
SCHEMBL8872985 0.83 ABL1 (0.37) ABL1SRCADAM17ITGB1ITGA4
SCHEMBL8958388 0.81 WNT3A (0.37) ABL1BCL2MCL1MAP4K1GSK3A
SCHEMBL8872016 0.79 MME (0.37) ABL1CTSAEGLN1ITGB1ITGA4

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