SCHEMBL4009971

SCHEMBL4009971

O=C(O)c1cccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)c1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.82
AKR1C3 P42330 10/20 0.54
AKR1C1 Q04828 3/20 0.54
AKR1C2 P52895 1/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL4010751 0.92 FAAH (0.85) FAAHAKR1C3AKR1C1AKR1C2
SCHEMBL3941135 0.91 FAAH (1.00) FAAHAKR1C3AKR1C1MEN1KMT2A
SCHEMBL4016630 0.91 FAAH (0.75) FAAHAKR1C3AKR1C1AKR1C2
SCHEMBL4017386 0.90 FAAH (0.73) FAAHAKR1C3AKR1C1AKR1C2
SCHEMBL3934243 0.87 FAAH (0.83) FAAHAKR1C3MEN1KMT2A
SCHEMBL3939389 0.87 FAAH (0.83) FAAHAKR1C3MEN1KMT2A
SCHEMBL3932908 0.87 FAAH (0.83) FAAHAKR1C3MEN1KMT2A
SCHEMBL3939612 0.87 FAAH (0.83) FAAHAKR1C3AKR1C2MEN1KMT2A
SCHEMBL3942978 0.87 FAAH (0.86) FAAH
SCHEMBL4015887 0.86 FAAH (0.76) FAAHAKR1C3

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