SCHEMBL10949047

SCHEMBL10949047

CC(S)CCCCCC(C)S

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.36
TRPA1 O75762 1/20 0.36
LMNA P02545 1/20 0.35
OPRM1 P35372 1/20 0.32
SPHK1 Q9NYA1 1/20 0.31

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
SCHEMBL10945025 1.00 TRPV1 (0.36) TRPV1TRPA1LMNAOPRM1SPHK1
SCHEMBL1171781 1.00 TRPV1 (0.36) TRPV1TRPA1LMNAOPRM1SPHK1
SCHEMBL16646714 1.00 TRPV1 (0.36) TRPV1TRPA1LMNAOPRM1SPHK1
SCHEMBL10945633 0.96 LMNA (0.37) TRPV1TRPA1LMNAOPRM1
SCHEMBL3009232 0.88
SCHEMBL25229480 0.87 FOLH1 (0.35) TRPV1TRPA1
SCHEMBL276707 0.87 OPRM1 (0.50) LMNAOPRM1SPHK1
SCHEMBL3614545 0.87 OPRM1 (0.50) LMNAOPRM1SPHK1
SCHEMBL3614477 0.87 OPRM1 (0.50) LMNAOPRM1SPHK1
SCHEMBL20952371 0.87 OPRM1 (0.50) LMNAOPRM1SPHK1

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-4544796-A Solvent extraction of aromatic compounds using alkylsulfoxide solvents UOP INC. (US) 1985-10-01 US disclosed