SCHEMBL9700475

SCHEMBL9700475

CCCCCCCCC=CCCCCCCCC(=O)c1nccn1C(C)C

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.52
CES1 P23141 2/20 0.52
DAGLA Q9Y4D2 1/20 0.45

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
SCHEMBL3963375 0.83 FAAH (0.55) FAAHCES1DAGLA
Hydrochloric Acid SCHEMBL9701700 0.77 KDM4E (0.46) FAAHCES1
Acetic Acid SCHEMBL11873149 0.75 FAAH (0.47) FAAHCES1
SCHEMBL13662373 0.73 FAAH (0.54) FAAHCES1
SCHEMBL13662384 0.73 FAAH (0.62) FAAHCES1DAGLA
SCHEMBL7798763 0.71 FAAH (0.50) FAAHCES1
Hydrochloric Acid SCHEMBL10938083 0.70 TERT (0.61) FAAH
SCHEMBL10615856 0.69 DAGLA (0.58) FAAHCES1DAGLA
SCHEMBL10615862 0.69 DAGLA (0.58) FAAHCES1DAGLA
SCHEMBL7553685 0.69 TLR8 (0.49) FAAHCES1

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-0518458-A1 Fatty imidazolium salts TEXACO CHEMICAL COMPANY (US) 1992-12-16 EP disclosed