SCHEMBL3476090

SCHEMBL3476090

FC(F)(F)Oc1ccc(-c2ccc3oc(NC4CCCCC4)nc3c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.61
HDAC6 Q9UBN7 2/20 0.51
PIK3CA P42336 1/20 0.51
SSTR5 P35346 1/20 0.48
GABBR2 O75899 1/20 0.47
GABBR1 Q9UBS5 1/20 0.47
FBP1 P09467 1/20 0.45
GALR2 O43603 1/20 0.45
GALR1 P47211 1/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
USP30 Q70CQ3 1/20 0.43

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
SCHEMBL3477307 0.82 FAAH (0.66) FAAHHDAC6PIK3CAMAPT
SCHEMBL3477409 0.81 FAAH (0.71) FAAHHDAC6PIK3CANPC1MAPT
SCHEMBL3475819 0.81 FAAH (0.65) FAAHHDAC6PIK3CANPC1RAB9A
SCHEMBL3477061 0.80 FAAH (0.58) FAAHHDAC6PIK3CAMAPT
SCHEMBL3476787 0.80 FAAH (0.72) FAAHHDAC6PIK3CASSTR5SMN1; SMN2
SCHEMBL13543032 0.80 SSTR5 (0.54) FAAHHDAC6PIK3CASSTR5FBP1
Bromide SCHEMBL3568591 0.79 SSTR5 (0.53) FAAHHDAC6PIK3CASSTR5FBP1
SCHEMBL3475830 0.78 FAAH (0.64) FAAHHDAC6PIK3CASSTR5
SCHEMBL3477428 0.78 FAAH (0.64) FAAHHDAC6PIK3CA
SCHEMBL13436763 0.78 FAAH (0.76) FAAHHDAC6PIK3CASSTR5MAPT

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