SCHEMBL11766949

SCHEMBL11766949

CCCCCCCC/C=C\CCCCCCCCOCCCCCCCC/C=C\CCCCCCCC.O=S(=O)(O)OCCO

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ EPHX2 P34913 2/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ TRPV1 Q8NER1 1/20 0.47
▸ MGLL Q99685 1/20 0.44
▸ LPAR1 Q92633 1/20 0.43
▸ LPAR2 Q9HBW0 1/20 0.43
▸ LPAR3 Q9UBY5 1/20 0.43
▸ PPARA Q07869 1/20 0.43

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
Oleyl Sulfate SCHEMBL8099677 0.94 MEN1 (0.51) MEN1THRBHTTKMT2AMAPT
SCHEMBL11766954 0.91 EPHX2 (0.47) MEN1THRBHTTKMT2AMAPT
SCHEMBL16589843 0.91 EPHX2 (0.47) MEN1THRBHTTKMT2AMAPT
Oleyl Alcohol SCHEMBL28546513 0.88 CNR2 (0.46) CNR2TRPV1LPAR1LPAR2LPAR3
SCHEMBL16589842 0.88 LPAR2 (0.49) MEN1THRBHTTKMT2AMAPT
SCHEMBL6860181 0.87 CA1 (0.50) EPHX2TRPV1LPAR1LPAR2LPAR3
SCHEMBL16589813 0.87 CA1 (0.50) EPHX2TRPV1LPAR1LPAR2LPAR3
SCHEMBL143489 0.87 CA1 (0.50) EPHX2TRPV1LPAR1LPAR2LPAR3
Oleyl Sulfate SCHEMBL29167 0.87 CA1 (0.50) EPHX2TRPV1LPAR1LPAR2LPAR3
Oleyl Sulfate SCHEMBL146103 0.87 CA1 (0.50) EPHX2TRPV1LPAR1LPAR2LPAR3

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-4013615-A VINYL CHLORIDE MONOMER, PIGMENT, SURFACTANT, INITIATOR, EMULSION COPOLYMERIZATION TEKKOSHA CO., LTD. (JA) 1977-03-22 — — US disclosed
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