Sugi Predict

Sugi Predict / Compounds / SCHEMBL3941391

SCHEMBL3941391

SCHEMBL3941391

O=S(=O)(c1ccccc1-c1ccccc1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 11/20 0.77
▸ FABP1 P07148 5/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ EPHX2 P34913 1/20 0.37
▸ PIK3CA P42336 1/20 0.36
▸ ALOX5AP P20292 1/20 0.36
▸ FEN1 P39748 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
SCHEMBL3930696 0.93 FAAH (0.72) FAAHFABP1ALDH1A1LMNAMAPK1
SCHEMBL3932778 0.93 FAAH (0.70) FAAHFABP1ALDH1A1LMNAMAPK1
SCHEMBL3933996 0.91 FAAH (0.67) FAAHFABP1LMNA
SCHEMBL3936263 0.88 FAAH (0.90) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3938565 0.88 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3934364 0.88 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3939171 0.88 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3931443 0.88 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3942409 0.88 FAAH (0.77) FAAHALDH1A1LMNAMAPK1HTT
SCHEMBL3936894 0.88 FAAH (0.79) 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