SCHEMBL9869502

SCHEMBL9869502

CCCCCCCCC/C=C/COCCCC

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.50
TRPV1 Q8NER1 1/20 0.50
LPAR3 Q9UBY5 2/20 0.47
LPAR1 Q92633 1/20 0.47
LPAR2 Q9HBW0 1/20 0.47

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
SCHEMBL9869504 1.00 FAAH (0.50) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL5873976 0.98 FAAH (0.46) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL5873974 0.98 FAAH (0.46) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL26753904 0.96 LPAR1 (0.52) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL27445901 0.96 LPAR1 (0.52) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL27512003 0.93 LPAR1 (0.48) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL6691272 0.91 FAAH (0.50) FAAHTRPV1LPAR3LPAR1LPAR2
SCHEMBL2023671 0.89 FAAH (0.56) FAAHTRPV1
SCHEMBL15348172 0.89 FAAH (0.56) FAAHTRPV1
SCHEMBL1378623 0.89 FAAH (0.56) FAAHTRPV1

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
WO-1991003449-A1 ISOMERIZATION OF ALK-2-ENYL ETHERS GAF CHEMICALS CORPORATION (US) 1991-03-21 WO disclosed