SCHEMBL7769457

SCHEMBL7769457

CCCCCCCCCCCCCCCC(=O)C(O)C(O)(C(N)=O)C(=O)CCCC(CC)CCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ FFAR1 O14842 1/20 0.37
▸ FAAH O00519 4/20 0.36
▸ CES1 P23141 3/20 0.36
▸ CES2 O00748 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36

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
SCHEMBL9436013 0.89 FAAH (0.44) FAAHCES1CES2MEN1CYP1A2
SCHEMBL7769461 0.88 FFAR4 (0.41) FFAR4CA2FFAR1FAAHCES1
SCHEMBL28776256 0.74 SOAT1 (0.55) FFAR4CA2FFAR1FAAHCES1
SCHEMBL30312755 0.73 FAAH (0.48) FAAHCES1CES2MEN1CYP1A2
SCHEMBL30312783 0.73 FAAH (0.48) FAAHCES1CES2MEN1CYP1A2
SCHEMBL30312756 0.73 FAAH (0.48) FAAHCES1CES2MEN1CYP1A2
SCHEMBL30361058 0.73 FAAH (0.48) FAAHCES1CES2MEN1CYP1A2
SCHEMBL25300764 0.71 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL2733348 0.71 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2
SCHEMBL992830 0.71 FAAH (0.50) FAAHCES1CES2MEN1CYP1A2

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-0687722-B1 Biodegradable fabric conditioning molecules based on glyceric acid UNILEVER PLC (GB) 2001-08-29 — — EP claimed
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