SCHEMBL3932061

SCHEMBL3932061

O=S(=O)(CCc1ccccc1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.73
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ABCB1 P08183 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
GRM4 Q14833 1/20 0.35

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
SCHEMBL3932857 0.94 FAAH (0.68) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3938179 0.93 FAAH (0.71) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3939496 0.91 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3941324 0.89 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3935806 0.89 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3932306 0.88 FAAH (0.71) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3934131 0.88 FAAH (0.71) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3932773 0.87 FAAH (0.70) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3929241 0.87 FAAH (0.70) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL8132711 0.86 FAAH (0.73) FAAHALDH1A1LMNAMAPK1HTT

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