SCHEMBL7905480

SCHEMBL7905480

OC1CCCC[C@@]1(O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.42
NPY1R P25929 1/20 0.42
HTT P42858 1/20 0.42
NPY2R P49146 1/20 0.42
CNR1 P21554 1/20 0.42
AKR1C1 Q04828 1/20 0.41
TRPA1 O75762 1/20 0.41
OPRM1 P35372 3/20 0.40
OPRL1 P41146 3/20 0.40
SLC6A9 P48067 3/20 0.40
SLC6A5 Q9Y345 3/20 0.40

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
SCHEMBL6933056 1.00 CNR2 (0.42) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL6543483 1.00 CNR2 (0.42) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL7911972 1.00 CNR2 (0.42) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL1852711 1.00 CNR2 (0.42) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL7911980 1.00 CNR2 (0.42) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL11400432 0.98 CNR2 (0.41) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL1866342 0.94 CNR2 (0.40) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL8754397 0.86 SLC18A3 (0.43) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL7750595 0.86 PTGS2 (0.41) CNR2NPY1RHTTNPY2RCNR1
SCHEMBL30207528 0.80 SLC6A4 (0.59) CNR2OPRM1OPRL1SLC6A9SLC6A5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197994-B1 PREPARING VICINAL DIOLS BY CATALYTIC ASYMMETRIC DIHYDROXYLATION OF OLEFINS USING SILICA GEL SUPPORTED BIS-CINCHONA ALKALOID DERIVATIVE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2001-03-06 US disclosed
US-5968867-A REUSABLE CATALYSTS FOR DIHYDROXYLATION OF OLEFINS TO OPTICALLY-ACTIVE VICINAL DIOLS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1999-10-19 US disclosed