SCHEMBL3475438

SCHEMBL3475438

COc1ncc(-c2ccc3oc(Nc4ccccc4)nc3c2)cn1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.57
GAA P10253 3/20 0.51
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 1/20 0.51
PKM P14618 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CASP3 P42574 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
HDAC6 Q9UBN7 2/20 0.48
DGAT1 O75907 1/20 0.48
POLB P06746 1/20 0.44
MAPT P10636 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
SCHEMBL13436779 0.87 FAAH (0.56) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3476682 0.83 FAAH (0.60) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3477398 0.82 FAAH (0.58) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3475760 0.81 FAAH (0.60) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL13436717 0.80 FAAH (0.56) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3475856 0.80 FAAH (0.65) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3476760 0.80 FAAH (0.56) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3474807 0.79 FAAH (0.60) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL3475759 0.79 FAAH (0.57) FAAHGAARAB9ANPC1SMN1; SMN2
SCHEMBL13436702 0.77 FAAH (0.61) FAAHGAARAB9ANPC1SMN1; SMN2

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