SCHEMBL3478424

SCHEMBL3478424

CC(C)Cn1ccc2cc(-c3ccc4oc(Nc5ccccc5)nc4c3)ccc21

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.79
NPC1 O15118 2/20 0.46
GAA P10253 2/20 0.46
RAB9A P51151 2/20 0.46
MEN1 O00255 1/20 0.46
CASP3 P42574 1/20 0.46
KMT2A Q03164 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
HDAC6 Q9UBN7 1/20 0.45
DGAT1 O75907 1/20 0.45
ALDH1A1 P00352 1/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 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 0.89 FAAH (1.00) FAAHNPC1GAARAB9AMEN1
SCHEMBL3478157 0.84 FAAH (0.76) FAAHNPC1GAARAB9AMEN1
SCHEMBL3477803 0.84 FAAH (0.76) FAAHNPC1GAARAB9AMEN1
SCHEMBL3476992 0.83 FAAH (1.00) FAAH
SCHEMBL3477974 0.82 FAAH (0.73) FAAHNPC1GAARAB9AMEN1
SCHEMBL13436721 0.81 FAAH (0.71) FAAHNPC1GAARAB9AMEN1
SCHEMBL3477010 0.76 FAAH (0.68) FAAHNPC1GAARAB9AMEN1
SCHEMBL3475856 0.74 FAAH (0.65) FAAHNPC1GAARAB9AMEN1
SCHEMBL13436641 0.74 FAAH (0.58) FAAHNPC1GAARAB9AMEN1
SCHEMBL3478143 0.73 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