SCHEMBL7740349

SCHEMBL7740349

CCCCCCCCCCS(=O)(=O)C(C)CCCC

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.57
FAAH O00519 2/20 0.46
TP53 P04637 1/20 0.45
DNM1 Q05193 2/20 0.41
OPRM1 P35372 1/20 0.39
CES1 P23141 4/20 0.39
SPHK1 Q9NYA1 1/20 0.38

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
SCHEMBL34463419 0.96 CA2 (0.57) CA2FAAHTP53OPRM1CES1
SCHEMBL8684782 0.82 CA2 (0.45) CA2FAAHTP53OPRM1SPHK1
SCHEMBL11457768 0.82 TP53 (0.50) CA2TP53OPRM1SPHK1
SCHEMBL11466780 0.82 TP53 (0.50) CA2TP53OPRM1SPHK1
SCHEMBL17138111 0.80 CA2 (0.64) CA2FAAHTP53OPRM1CES1
SCHEMBL11101496 0.79 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL1911477 0.79 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL14519882 0.79 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL27050891 0.79 CA2 (0.63) CA2FAAHTP53CES1
SCHEMBL11566341 0.78 CA2 (0.52) CA2FAAHTP53DNM1OPRM1

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-6265118-B1 THIADIAZOLE DYTES; LIGHTFASTNESS; DIFFUSION DYE TRANSFER FUJI PHOTO FILM CO., LTD. (JP) 2001-07-24 US disclosed