SCHEMBL7083706

SCHEMBL7083706

Cc1cccc(-c2ccccc2)c1C(=O)Nc1ccc(NCCc2ccccn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
CNR1 P21554 1/20 0.44
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 3/20 0.43
LMNA P02545 1/20 0.43
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
CYP3A4 P08684 1/20 0.41
PTGFR P43088 1/20 0.41
CTNNB1 P35222 1/20 0.41
TCF7L2 Q9NQB0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41
SMO Q99835 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR1 O14842 1/20 0.41

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
SCHEMBL6490478 0.90 TRPV1 (0.51) ALDH1A1SMO
SCHEMBL7080544 0.89 MAPT (0.47) RAB9ANPC1TAS1R3TAS1R1CNR1
SCHEMBL6681168 0.89 RAB9A (0.46) RAB9ANPC1TAS1R3TAS1R1CNR1
SCHEMBL6498735 0.85 RAB9A (0.46) RAB9ANPC1TAS1R3TAS1R1CNR1
SCHEMBL6681166 0.84 RAB9A (0.43) RAB9ANPC1TAS1R3TAS1R1CNR1
SCHEMBL6796673 0.84 HTT (0.59) RAB9ANPC1CNR1MAPTHTT
SCHEMBL6492508 0.82 SMN1; SMN2 (0.52) RAB9ANPC1TAS1R3TAS1R1CNR1
SCHEMBL6791511 0.82 HTT (0.57) RAB9ANPC1CNR1MAPTHTT
Hydrochloric Acid SCHEMBL7079728 0.82 SMN1; SMN2 (0.51) RAB9ANPC1TAS1R3TAS1R1MAPT
SCHEMBL6683560 0.82 CTNNB1 (0.46) RAB9ANPC1TAS1R3TAS1R1CNR1

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
EP-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 WO disclosed