SCHEMBL3942978

SCHEMBL3942978

O=S(=O)(c1ccc2ccccc2c1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.86
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
GBA1 P04062 1/20 0.41
PKM P14618 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL3941135 0.93 FAAH (1.00) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3942437 0.92 FAAH (0.88) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3930792 0.91 FAAH (0.80) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3934606 0.91 FAAH (0.80) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3933839 0.91 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3933960 0.91 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3936263 0.91 FAAH (0.90) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3930701 0.91 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3941586 0.91 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT
SCHEMBL3941343 0.91 FAAH (0.86) FAAHLMNAALDH1A1MAPK1HTT

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