SCHEMBL8060798

SCHEMBL8060798

COc1ccc(-c2cc(C)ccc2C=O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.66
TRIM24 O15164 1/20 0.66
TRIM33 Q9UPN9 1/20 0.66
ERN1 O75460 4/20 0.57
ALDH1A1 P00352 3/20 0.50
AR P10275 1/20 0.45
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 0.44
NOTUM Q6P988 1/20 0.43
NPC1 O15118 4/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
CYP3A4 P08684 1/20 0.41
HPGD P15428 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
SCHEMBL343958 0.81 TRIM24 (0.65) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL133876 0.80 TYR (1.00) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL10899140 0.80 ALDH1A1 (0.50) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL28150290 0.79 TYR (0.96) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL11420339 0.79 TYR (0.96) TYRTRIM24TRIM33ERN1ALDH1A1
Hydrogen Sulfide SCHEMBL28156220 0.79 TYR (0.96) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL4456426 0.79 TYR (0.96) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL28337239 0.79 TYR (0.96) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL340086 0.76 NPC1 (0.60) TYRTRIM24TRIM33ERN1ALDH1A1
SCHEMBL15094048 0.76 TRIM24 (0.61) TYRTRIM24TRIM33ERN1ALDH1A1

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-6114561-A Silicone sunscreening esters O'LENICK JR ANTHONY J (US) 2000-09-05 US disclosed