SCHEMBL8873040

SCHEMBL8873040

CCCC(=O)Nc1cnc(Cc2ccc(-c3ccccc3C(=O)OC)cc2)c([N+](=O)[O-])c1C

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.54
LTB4R2 Q9NPC1 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BRS3 P32247 1/20 0.39

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
SCHEMBL8872322 0.95 BDKRB1 (0.55) BDKRB1LTB4R2ALDH1A1MEN1KMT2A
SCHEMBL8873215 0.86 BDKRB1 (0.41) BDKRB1ALDH1A1BRS3
SCHEMBL8873832 0.85 BDKRB1 (0.48) BDKRB1LTB4R2
SCHEMBL8872745 0.83 BDKRB1 (0.49) BDKRB1LTB4R2ALDH1A1MEN1KMT2A
SCHEMBL8873289 0.80 BDKRB1 (0.49) BDKRB1LTB4R2ALDH1A1MEN1KMT2A
SCHEMBL8958440 0.79 BDKRB1 (0.50) BDKRB1LTB4R2ALDH1A1MEN1KMT2A
SCHEMBL8872358 0.72 BDKRB1 (0.38) BDKRB1ALDH1A1BRS3
SCHEMBL6106685 0.72 SMN1; SMN2 (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8872353 0.71 SLC6A3 (0.40) BDKRB1ALDH1A1
SCHEMBL8872739 0.71 LTB4R2 (0.52) BDKRB1LTB4R2BRS3

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 4 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-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