SCHEMBL9504187

SCHEMBL9504187

COC(=O)c1ccc(N(C)C)c(N)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.69
GAA P10253 6/20 0.69
MAPK1 P28482 3/20 0.69
KDM4E B2RXH2 9/20 0.62
ALDH1A1 P00352 9/20 0.62
HPGD P15428 7/20 0.62
HSD17B10 Q99714 4/20 0.62
GLA P06280 1/20 0.62
CASP1 P29466 1/20 0.62
CASP7 P55210 1/20 0.62
ATM Q13315 1/20 0.62
USP2 O75604 1/20 0.53
NPC1 O15118 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALOX15 P16050 2/20 0.49
PKM P14618 1/20 0.49

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
SCHEMBL24661296 0.87 MAPT (0.58) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL21606300 0.83 MAPT (0.54) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL9632299 0.82 MAPT (0.57) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL30605798 0.82 MAPT (1.00) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL864926 0.82 MAPT (1.00) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL122553 0.81 KDM4E (0.54) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL7569377 0.80 GAA (0.76) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL4433442 0.80 GAA (0.65) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL192100 0.80 KDM4E (0.72) MAPTGAAMAPK1KDM4EALDH1A1
SCHEMBL29375113 0.80 KDM4E (0.72) MAPTGAAMAPK1KDM4EALDH1A1

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-0543884-A1 BENZANILIDE DERIVATIVES AND THEIR USE AS ANTI-ATHEROSCLEROTIC AGENTS RHONE-POULENC RORER LIMITED (GB) 1993-06-02 EP disclosed
WO-1992003408-A1 BENZANILIDE DERIVATIVES AND THEIR USE AS ANTI-ANTHEROSCLEROTIC AGENTS RHONE-POULENC RORER LIMITED (GB) 1992-03-05 WO disclosed