SCHEMBL9807232

SCHEMBL9807232

CC(C)(C)c1ccc(OC(=O)c2ccccc2O)cc1.CCCCCCCCc1ccccc1OC(=O)c1ccccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.53
MAPT P10636 2/20 0.53
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 3/20 0.44
HSD17B10 Q99714 3/20 0.44
ALOX15 P16050 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ESRRG P62508 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
KAT8 Q9H7Z6 2/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
EP300 Q09472 1/20 0.41

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
SCHEMBL8079737 0.89 MAPT (0.51) NPSR1MAPTTHRATHRBHPGD
SCHEMBL30431680 0.88 THRA (0.60) MAPTTHRATHRBHPGDHSD17B10
SCHEMBL78018 0.88 THRA (0.60) MAPTTHRATHRBHPGDHSD17B10
SCHEMBL2804125 0.88 THRA (0.60) MAPTTHRATHRBHPGDHSD17B10
Phenyl Salicylate SCHEMBL10436750 0.87 HPGD (0.52) NPSR1MAPTTHRATHRBHPGD
Methane SCHEMBL27981233 0.87 THRA (0.59) MAPTTHRATHRBHPGDHSD17B10
SCHEMBL11770686 0.86 THRA (0.51) NPSR1MAPTTHRATHRBBID
SCHEMBL11770518 0.86 THRA (0.51) NPSR1MAPTTHRATHRBBID
SCHEMBL9438255 0.84 MAPT (0.48) NPSR1MAPTTHRATHRBHPGD
SCHEMBL410853 0.83 HPGD (0.55) THRATHRBHPGDHSD17B10ALOX15

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
US-5019613-A Light stabilizers CIBA-GEIGY CORPORATION (US) 1991-05-28 US disclosed