SCHEMBL22013849

SCHEMBL22013849

C=C/C=C(\C)OCC(O)COc1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48
MAPT P10636 4/20 0.45
LMNA P02545 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
POLB P06746 2/20 0.45
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 3/20 0.41
ATM Q13315 1/20 0.39

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
SCHEMBL13613338 0.80 USP2 (0.54) USP2TSHRMAPTLMNANPSR1
SCHEMBL14189198 0.79 USP2 (0.68) USP2TSHRMAPTLMNANPSR1
SCHEMBL2121270 0.78 POLB (0.50) USP2TSHRMAPTLMNANPSR1
SCHEMBL18965637 0.78 LMNA (0.44) TSHRMAPTLMNANPSR1POLB
SCHEMBL2032040 0.75 POLB (0.54) USP2TSHRMAPTLMNANPSR1
SCHEMBL11513661 0.75 USP2 (0.55) USP2TSHRMAPTLMNANPSR1
SCHEMBL19021801 0.74 USP2 (0.62) USP2TSHRMAPTLMNANPSR1
SCHEMBL17212342 0.73 ATM (0.61) USP2TSHRMAPTLMNANPSR1
SCHEMBL12133451 0.73 USP2 (0.60) USP2TSHRMAPTLMNANPSR1
SCHEMBL7082811 0.73 MAPT (0.68) TSHRMAPTLMNANPSR1POLB

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-10662279-B2 Epoxy resin composition, semi-cured epoxy resin composition, cured epoxy resin composition, molded article, and cured molded article HITACHI CHEMICAL COMPANY, LTD. (JP) 2020-05-26 US disclosed