SCHEMBL28348656

SCHEMBL28348656

C=CC(=O)OCCOc1c(O)cc(C(=O)c2ccccc2)c(O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.52
HPGD P15428 4/20 0.39
HSD17B10 Q99714 4/20 0.39
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 3/20 0.39
RECQL P46063 2/20 0.39
BCL2 P10415 1/20 0.39
MCL1 Q07820 1/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
MAPK1 P28482 2/20 0.36
ALOX15 P16050 2/20 0.36
ALDH1A1 P00352 4/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL14892866 0.83 THRB (0.55) THRBHPGDHSD17B10MAPTKDM4E
SCHEMBL28345258 0.82 ELANE (0.41) HPGDHSD17B10MAPTKDM4ELMNA
SCHEMBL28019921 0.81 THRB (0.55) THRBHPGDHSD17B10MAPTKDM4E
SCHEMBL28803940 0.80 THRB (0.51) THRBHPGDHSD17B10MAPTKDM4E
SCHEMBL5478807 0.80 CCNB2 (0.50) HPGDHSD17B10MAPTKDM4ELMNA
SCHEMBL29396444 0.80 THRB (0.60) THRBHPGDMAPTLMNACYP3A4
SCHEMBL64457 0.80 THRB (0.60) THRBHPGDMAPTLMNACYP3A4
SCHEMBL5478166 0.79 CCNB2 (0.47) HPGDHSD17B10MAPTKDM4ELMNA
SCHEMBL29833518 0.78 THRB (0.61) THRBHSD17B10MAPTKDM4ELMNA
SCHEMBL721896 0.78 THRB (0.61) THRBHSD17B10MAPTKDM4ELMNA

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
CN-110621710-A Active energy ray-curable resin composition, hard coat laminated film, and film for external glass 理研科技株式会社 2019-12-27 CN disclosed