SCHEMBL16064906

SCHEMBL16064906

CC[C@H](O)[C@@H](O)c1c(C)cccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
TRPA1 O75762 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
DRD2 P14416 2/20 0.34
DRD3 P35462 2/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.33
CASP1 P29466 1/20 0.33
ALDH1A1 P00352 3/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
ESR1 P03372 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 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
SCHEMBL19254710 1.00 KDM4E (0.35) KDM4ETAS1R3TAS1R1TAS1R2TRPA1
SCHEMBL252914 0.88 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TRPA1MEN1
SCHEMBL253181 0.88 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TRPA1MEN1
SCHEMBL253180 0.88 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TRPA1MEN1
SCHEMBL252915 0.88 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TRPA1MEN1
SCHEMBL252916 0.88 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TRPA1MEN1
SCHEMBL16064835 0.85 MEN1 (0.36) KDM4ETAS1R3TAS1R1TAS1R2MEN1
SCHEMBL18567950 0.82 KDM4E (0.34) KDM4ETAS1R3TAS1R1TAS1R2MEN1
SCHEMBL16070561 0.82 KDM4E (0.34) KDM4ETAS1R3TAS1R1TAS1R2MEN1
SCHEMBL16070804 0.81 GAA (0.35) TRPA1GAAALDH1A1CA1CA2

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
WO-2014142549-A1 PHENYL CARBAMATE COMPOUND AND A COMPOSITION FOR PREVENTING OR TREATING A MEMORY LOSS-RELATED DISEASE COMPRISING THE SAME BIO-PHARM SOLUTIONS CO., LTD. (KR) 2014-09-18 WO disclosed