SCHEMBL3934290

SCHEMBL3934290

CN1CCC(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)CC1

nearest known ligand 0.86

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.86
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
EGFR P00533 1/20 0.40
JAK3 P52333 1/20 0.40
BTK Q06187 1/20 0.40
HTR7 P34969 3/20 0.38
EPHX2 P34913 1/20 0.38
HTR6 P50406 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
TNF P01375 1/20 0.37
HTR3A P46098 1/20 0.36

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
SCHEMBL3938587 0.94 FAAH (0.93) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3932847 0.94 FAAH (0.98) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3933589 0.93 FAAH (1.00) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936303 0.93 FAAH (1.00) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3935806 0.86 FAAH (0.78) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4012855 0.85 FAAH (0.79) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL8129408 0.85 FAAH (0.85) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL4011983 0.84 FAAH (0.75) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936102 0.83 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3941135 0.83 FAAH (1.00) 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