SCHEMBL11520193

SCHEMBL11520193

CCCCCCCCCCCCc1ccc(O)cc1CCCCCCCCCCCC.CCCCCCCCCc1ccccc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.71
CYP3A4 P08684 3/20 0.71
MAPT P10636 2/20 0.71
TP53 P04637 2/20 0.71
MEN1 O00255 1/20 0.71
ALOX5 P09917 1/20 0.71
ALOX15 P16050 1/20 0.71
TSHR P16473 1/20 0.71
HTT P42858 1/20 0.71
KMT2A Q03164 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
HSD17B10 Q99714 2/20 0.55
USP2 O75604 1/20 0.55
GLA P06280 1/20 0.55
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
CASP1 P29466 1/20 0.55
CASP7 P55210 1/20 0.55

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
Hydroquinone SCHEMBL9768877 0.89 CYP3A4 (0.66) TYRCYP3A4MAPTTP53MEN1
SCHEMBL11256971 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL10825654 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL10628881 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL10825694 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL30763512 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL10825916 0.88 ALOX5 (0.76) TYRCYP3A4MAPTTP53MEN1
SCHEMBL28793655 0.87 ALOX5 (0.73) TYRCYP3A4MAPTTP53MEN1
SCHEMBL10825680 0.87 ALOX5 (0.72) TYRCYP3A4MAPTTP53MEN1
SCHEMBL272645 0.87 LIPG (0.63) TYRCYP3A4MAPTTP53MEN1

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-4171269-A OVERBASED CALCIUM ALKYLPHENOLATE, CALCIUM HYDROCARBYL SULFONATE, SULFURIZED NAPTHENIC OIL, CHLOROPARAFFIN TEXACO INC. (US) 1979-10-16 US disclosed