SCHEMBL8638970

SCHEMBL8638970

CCCCCCCCCC(C(C)CCCC)(C(C)CCCC)C(C)CCCC

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.44
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
OPRM1 P35372 1/20 0.37
GGPS1 O95749 6/20 0.35
SPHK1 Q9NYA1 1/20 0.35
FDPS P14324 9/20 0.35
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CES2 O00748 1/20 0.33

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
SCHEMBL10479574 0.77 OPRM1 (0.39) DNM1TSHRTHRBOPRM1GGPS1
SCHEMBL16209746 0.77 OPRM1 (0.39) DNM1TSHRTHRBOPRM1GGPS1
SCHEMBL10347967 0.77 OPRM1 (0.39) DNM1TSHRTHRBOPRM1GGPS1
SCHEMBL9405010 0.77 FDPS (0.41) DNM1GGPS1SPHK1FDPS
SCHEMBL10840501 0.77 OPRM1 (0.39) DNM1TSHRTHRBOPRM1GGPS1
SCHEMBL3048556 0.77 TSHR (0.44) DNM1TSHRTHRBGGPS1FDPS
SCHEMBL2348897 0.76 GGPS1 (0.41) DNM1TSHRGGPS1FDPSSMN1; SMN2
Bromide SCHEMBL7508390 0.76 DNM1 (0.39) DNM1TSHRTHRBOPRM1GGPS1
SCHEMBL6947597 0.76 FDPS (0.40) DNM1GGPS1SPHK1FDPS
SCHEMBL28130437 0.76 FDPS (0.40) DNM1GGPS1SPHK1FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0709465-B1 Optical resolution for producing optically active alcohol NISSHIN OIL MILLS LTD (JP) 1998-08-05 EP disclosed
US-5696299-A Optical resolution for producing optically active alcohol THE NISSHIN OIL MILLS, LTD. (JP) 1997-12-09 US disclosed
EP-0709465-A2 Optical resolution for producing optically active alcohol The Nisshin Oil Mills, Ltd. (JP) 1996-05-01 EP disclosed