SCHEMBL11439655

SCHEMBL11439655

CCCc1c(O)ccc(C(=O)C(O)c2ccccc2)c1O

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
PPARG P37231 2/20 0.43
PPARA Q07869 2/20 0.43
NAAA Q02083 2/20 0.40
MAPK1 P28482 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
HSP90AB1 P08238 1/20 0.38

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
SCHEMBL1940930 0.80 LMNA (0.53) LMNACES2CES1NAAAMAPK1
Hydrochloric Acid SCHEMBL30424145 0.79 LMNA (0.52) LMNACES2CES1NAAAMAPK1
SCHEMBL9821864 0.79 PRKCI (0.44) PPARGPPARAKDM4EHSP90AB1
SCHEMBL10726758 0.78 SELL (0.53) LMNAPPARGPPARAKDM4EALDH1A1
SCHEMBL2862125 0.78 MAPT (0.49) LMNAMAPK1KDM4EALDH1A1MEN1
SCHEMBL621111 0.77 LMNA (0.53) LMNACES2CES1MAPK1KDM4E
SCHEMBL11439654 0.76 LMNA (0.42) LMNACES2CES1KDM4EALDH1A1
SCHEMBL29104744 0.76 LMNA (0.42) LMNACES2CES1PPARGPPARA
SCHEMBL452704 0.76 LMNA (0.49) LMNACES2CES1PPARGPPARA
SCHEMBL7041414 0.75 LMNA (0.65) LMNAKDM4EALDH1A1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0028063-A1 Phenol derivatives, processes for their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1981-05-06 EP disclosed