SCHEMBL8766271

SCHEMBL8766271

CCCCCCCCCCCCOCC(O)CN(C)CCS(=O)(=O)O.[Na]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.49
HTT P42858 1/20 0.48
LPAR5 Q9H1C0 1/20 0.46
SPHK1 Q9NYA1 1/20 0.44
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
PLA2G2C Q5R387 5/20 0.40
GGPS1 O95749 3/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR3 Q9UBY5 2/20 0.36
PRKD3 O94806 1/20 0.35
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCI P41743 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCQ Q04759 1/20 0.35
PRKCZ Q05513 1/20 0.35

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
SCHEMBL8766266 0.85 LPAR5 (0.48) USP2HTTLPAR5SPHK1CYP1A2
Sulfuric Acid SCHEMBL28352823 0.85 USP2 (0.54) USP2HTTLPAR5SPHK1CYP1A2
Sulfuric Acid SCHEMBL28723401 0.85 USP2 (0.54) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL9615618 0.82 USP2 (0.50) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL3663196 0.82 USP2 (0.50) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL9807600 0.81 GPR84 (0.41) GGPS1
SCHEMBL1100606 0.80 USP2 (0.42) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL27824241 0.80 GPR84 (0.40) GGPS1
Sulfuric Acid SCHEMBL28938357 0.80 USP2 (0.51) USP2HTTLPAR5SPHK1CYP1A2
SCHEMBL7569353 0.80 USP2 (0.62) USP2HTTLPAR5SPHK1CYP1A2

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
EP-0788832-A1 Basic amino acid derivative for use as a surfactant, and toiletry or detergent composition containing the same Ajinomoto Co., Inc. (JP) 1997-08-13 EP disclosed