SCHEMBL3477803

SCHEMBL3477803

CN(C)CCn1ccc2cc(-c3ccc4oc(Nc5ccccc5)nc4c3)ccc21

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.76
HTR1D P28221 1/20 0.48
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
GAA P10253 1/20 0.47
CASP3 P42574 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
EGFR P00533 1/20 0.44

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
SCHEMBL3477451 0.87 FAAH (1.00) FAAHMEN1NPC1GAACASP3
SCHEMBL3478157 0.86 FAAH (0.76) FAAHMEN1NPC1GAACASP3
SCHEMBL3478424 0.84 FAAH (0.79) FAAHMEN1NPC1GAACASP3
SCHEMBL3476992 0.83 FAAH (1.00) FAAH
SCHEMBL13436721 0.83 FAAH (0.71) FAAHMEN1NPC1GAACASP3
SCHEMBL3477974 0.80 FAAH (0.73) FAAHMEN1NPC1GAACASP3
SCHEMBL3476178 0.76 FAAH (0.57) FAAHMEN1NPC1GAACASP3
SCHEMBL3477010 0.74 FAAH (0.68) FAAHMEN1NPC1GAACASP3
SCHEMBL3476611 0.74 FAAH (0.61) FAAHMEN1NPC1GAACASP3
SCHEMBL3478143 0.74 FAAH (0.81) FAAH

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-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed