SCHEMBL27754652

SCHEMBL27754652

CCCOC(=O)C(C)=C(C)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HCAR2 Q8TDS4 2/20 0.43
TSHR P16473 4/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 5/20 0.39
CHRM1 P11229 2/20 0.39
ESR1 P03372 1/20 0.39
SLC6A2 P23975 1/20 0.39
KDR P35968 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
THRB P10828 1/20 0.38
HSD17B10 Q99714 1/20 0.35
PPM1B O75688 1/20 0.34
PTPN1 P18031 1/20 0.34
PPP1CC P36873 1/20 0.34
CHRM5 P08912 1/20 0.32
CHRM3 P20309 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL10010712 0.87 TSHR (0.45) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL10010714 0.87 TSHR (0.45) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL28005421 0.86 ALDH1A1 (0.58) SMN1; SMN2HCAR2TSHRLMNAALDH1A1
SCHEMBL1593010 0.86 HCAR2 (0.43) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL7771313 0.84 HCAR2 (0.42) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL15962406 0.84 HCAR2 (0.42) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL7772523 0.84 HCAR2 (0.42) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL6877096 0.84 HCAR2 (0.42) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL129272 0.83 TSHR (0.42) GAASMN1; SMN2HCAR2TSHRLMNA
SCHEMBL26663553 0.83 TSHR (0.63) HCAR2TSHRLMNAALDH1A1

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
CN-101374905-A Antistatic thermoplastic resin composition and molded article composed thereof TORAY INDUSTRIES (JP) 2009-02-25 CN disclosed