SCHEMBL9567255

SCHEMBL9567255

CCCCCCCCCc1cc(Oc2ccc(O)c(CCCCCCCCC)c2)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.53
TSHR P16473 2/20 0.53
ALOX5 P09917 2/20 0.53
MEN1 O00255 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
CNR2 P34972 2/20 0.47
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
LTA4H P09960 1/20 0.45
PTGS2 P35354 1/20 0.44

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
Ethylene Glycol SCHEMBL8013191 0.92 TYR (0.46) TYRTSHRALOX5MEN1TP53
Ethylene Glycol SCHEMBL8027523 0.92 TYR (0.46) TYRTSHRALOX5MEN1TP53
SCHEMBL6576030 0.91 LTA4H (0.53) TYRTSHRALOX5MEN1TP53
SCHEMBL11799012 0.88 CNR2 (0.59) TYRTSHRALOX5MEN1TP53
SCHEMBL27281932 0.88 MTNR1A (0.58) TYRTSHRALOX5MEN1TP53
SCHEMBL10624538 0.88 MTNR1A (0.58) TYRTSHRALOX5MEN1TP53
SCHEMBL224134 0.88 CNR2 (0.59) TYRTSHRALOX5MEN1TP53
SCHEMBL11796028 0.88 CNR2 (0.59) TYRTSHRALOX5MEN1TP53
SCHEMBL9487130 0.88 MTNR1A (0.58) TYRTSHRALOX5MEN1TP53
SCHEMBL11801680 0.87 CNR2 (0.61) TSHRCNR2LTA4H

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-0565093-A1 A method of producing diorganopolysiloxane/acrylic acid ester graft copolymer emulsion Dow Corning Toray Silicone Company, Limited (JP) 1993-10-13 EP disclosed