SCHEMBL3476178

SCHEMBL3476178

CN(C)Cc1ccc(-c2ccc3oc(Nc4ccccc4)nc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.57
GAA P10253 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MEN1 O00255 1/20 0.55
CASP3 P42574 1/20 0.55
KMT2A Q03164 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
DGAT1 O75907 1/20 0.53
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
IL6 P05231 2/20 0.49
STAT3 P40763 2/20 0.49
HDAC6 Q9UBN7 2/20 0.48
TAAR1 Q96RJ0 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL3476611 0.84 FAAH (0.61) FAAHGAANPC1RAB9AMEN1
SCHEMBL3476893 0.84 DGAT1 (0.58) FAAHGAANPC1RAB9AMEN1
SCHEMBL3475759 0.83 FAAH (0.57) FAAHGAANPC1RAB9AMEN1
SCHEMBL3475856 0.82 FAAH (0.65) FAAHGAANPC1RAB9AMEN1
SCHEMBL3474216 0.80 FAAH (0.62) FAAHGAANPC1RAB9AMEN1
SCHEMBL3475208 0.80 FAAH (0.61) FAAHGAANPC1RAB9AMEN1
SCHEMBL3476446 0.80 FAAH (0.61) FAAHGAANPC1RAB9AMEN1
SCHEMBL13436702 0.80 FAAH (0.61) FAAHGAANPC1RAB9AMEN1
SCHEMBL3477311 0.80 FAAH (0.58) FAAHGAANPC1RAB9AMEN1
SCHEMBL18236217 0.78 IL6 (0.67) FAAHGAANPC1RAB9AMEN1

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