SCHEMBL8873067

SCHEMBL8873067

CCC(Cc1ccc(-c2ccccc2C#N)cc1)C(=O)Nc1nc(C)c(Cl)c(C)c1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.37
PPARG P37231 3/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RORC P51449 1/20 0.35
ADORA1 P30542 2/20 0.35
ADORA2A P29274 1/20 0.35
ALDH1A1 P00352 2/20 0.34
PTPN1 P18031 1/20 0.34
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33

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
SCHEMBL8872452 0.94 MME (0.36) MMEPPARGLMNATP53ITGB1
SCHEMBL8958734 0.91 ADORA1 (0.37) PPARGLMNATP53ADORA1ADORA2A
SCHEMBL8872885 0.90 MME (0.37) MMEPPARGLMNATP53ITGB1
SCHEMBL8872016 0.87 MME (0.37) MMEPPARGITGB1ITGA4L3MBTL1
SCHEMBL8873500 0.85 MME (0.38) MMEPPARGTP53ITGB1ITGA4
SCHEMBL8872477 0.84 MME (0.36) MMEPPARGLMNATP53ITGB1
SCHEMBL8873617 0.84 MME (0.37) MMEPPARGITGB1ITGA4L3MBTL1
SCHEMBL8875663 0.83 BDKRB1 (0.40) MMEPPARGITGB1ITGA4L3MBTL1
SCHEMBL8958405 0.81 ADORA1 (0.37) LMNATP53L3MBTL1ADORA1ADORA2A
SCHEMBL8873003 0.81 MME (0.36) MMEPPARGITGB1ITGA4L3MBTL1

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