SCHEMBL8566901

SCHEMBL8566901

CCOC(=O)c1cccc([N+](=O)[O-])c1N(Cc1ccc(-c2ccccc2C(=O)C(=O)OC)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 12/20 0.42
ALDH1A1 P00352 3/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AGTR1 P30556 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
GNRHR P30968 1/20 0.35
TP53 P04637 1/20 0.35
MMP1 P03956 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
KMT2A Q03164 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
SCHEMBL8566898 0.92 LTB4R2 (0.39) LTB4R2ALDH1A1GAASMN1; SMN2AGTR1
SCHEMBL7480667 0.85 L3MBTL1 (0.47) ALDH1A1GAASMN1; SMN2MAPTLMNA
SCHEMBL7015019 0.84 LTB4R2 (0.44) LTB4R2ALDH1A1SMN1; SMN2AGTR1MAPT
SCHEMBL4939408 0.81 LTB4R2 (0.41) LTB4R2ALDH1A1SMN1; SMN2MAPTLMNA
SCHEMBL9586936 0.81 FNTA (0.39) LTB4R2ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL16824598 0.80 AGT (0.39) LTB4R2ALDH1A1AGTR1MAPTLMNA
SCHEMBL9586519 0.79 FNTA (0.40) LTB4R2ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL9586285 0.79 FNTA (0.39) LTB4R2ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL9587776 0.79 FNTA (0.41) LTB4R2ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL9586917 0.78 FNTA (0.41) ALDH1A1GAASMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0603001-B1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO CO (JP) 1998-08-26 EP disclosed
US-5459148-A Cardiovascular disorders SANKYO COMPANY, LIMITED (JP) 1995-10-17 US disclosed
EP-0603001-A1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO COMPANY LIMITED (JP) 1994-06-22 EP disclosed