SCHEMBL3936249

SCHEMBL3936249

O=S(=O)(c1ccc(Cl)cc1F)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.72
ALPL P05186 2/20 0.47
MKNK1 Q9BUB5 8/20 0.46

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
SCHEMBL3934225 0.95 FAAH (0.72) FAAHALPLMKNK1
SCHEMBL3932111 0.93 FAAH (0.75) FAAHMKNK1
SCHEMBL3942409 0.91 FAAH (0.77) FAAHALPLMKNK1
SCHEMBL3934207 0.91 FAAH (0.73) FAAHALPLMKNK1
SCHEMBL3935789 0.91 FAAH (0.73) FAAHALPLMKNK1
SCHEMBL3930939 0.91 FAAH (0.73) FAAHALPL
SCHEMBL3934462 0.90 FAAH (0.72) FAAHALPLMKNK1
SCHEMBL3932629 0.88 FAAH (0.75) FAAHALPLMKNK1
SCHEMBL3936957 0.88 FAAH (0.75) FAAHALPLMKNK1
SCHEMBL3939171 0.88 FAAH (0.77) FAAHALPL

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-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed