SCHEMBL7308680

SCHEMBL7308680

CCCc1nc(C(C)(C)O)c(C(=O)OCOC(=O)C(C)(C)C)[nH]1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL987234 0.85 ALDH1A1 (0.42) KDM4EALDH1A1HPGDHTTRECQL
Water SCHEMBL21776630 0.84 ALDH1A1 (0.41) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL2121837 0.81 HCRTR1 (0.35) ALDH1A1HPGD
SCHEMBL1969215 0.81 CYP3A4 (0.34) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7298547 0.78 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL2626708 0.77 GLA (0.33) ALDH1A1GAA
SCHEMBL2121160 0.77 GLA (0.33) ALDH1A1GAA
SCHEMBL6857533 0.75 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL27446651 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL27334875 0.75 GAA (0.33) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0503785-B1 1-Biphenylimidazole derivatives, their preparation and their therapeutic use SANKYO CO (JP) 2001-04-25 EP disclosed
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-5646171-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1997-07-08 US disclosed
US-5616599-A HYPOTENSIVE AGENTS FOR CARDIOVASCULAR DISORDER SANKYO COMPANY, LIMITED (JP) 1997-04-01 US disclosed
US-5459148-A Cardiovascular disorders SANKYO COMPANY, LIMITED (JP) 1995-10-17 US disclosed
EP-0503785-A1 1-Biphenylimidazole derivatives, their preparation and their therapeutic use Sankyo Company Limited (JP) 1992-09-16 EP disclosed