SCHEMBL7083646

SCHEMBL7083646

Nc1cccc(COc2ccc(NC(=O)c3cc(C(F)(F)F)ccc3-c3ccccc3)cn2)n1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
HTR2C P28335 3/20 0.46
HTR2A P28223 2/20 0.46
HTR2B P41595 2/20 0.46
LRRK2 Q5S007 4/20 0.44
RAB9A P51151 1/20 0.43
KIT P10721 1/20 0.42
KDR P35968 1/20 0.42
MAPK14 Q16539 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
SRPK3 Q9UPE1 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
NTRK1 P04629 1/20 0.40

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
SCHEMBL6795248 0.90 SMO (0.47) GAAHTR2CHTR2AHTR2BRAB9A
SCHEMBL6259089 0.83 GAA (0.53) GAALRRK2RAB9ASRPK3NPC1
SCHEMBL7083682 0.82 CA12 (0.45) RAB9ANPC1MAPT
SCHEMBL7084422 0.82 ITGB1 (0.44) GAALRRK2KDRNTRK1
SCHEMBL7084075 0.82 CA12 (0.43) LRRK2MAPT
SCHEMBL6499436 0.81 RAB9A (0.46) GAAHTR2CHTR2AHTR2BRAB9A
SCHEMBL7086871 0.81 HTR2C (0.49) GAAHTR2CHTR2AHTR2BLRRK2
SCHEMBL6793010 0.79 HTR2C (0.50) GAAHTR2CHTR2AHTR2BRAB9A
SCHEMBL7084151 0.79 CA12 (0.43) RAB9AKITNPC1MAPT
SCHEMBL6924381 0.78 GAA (0.45) GAAHTR2CHTR2AHTR2BLRRK2

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