SCHEMBL6664832

SCHEMBL6664832

Cc1ccccc1CNC(=O)c1ccc2c(c1)ncn2-c1n[nH]c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 8/20 0.54
LMNA P02545 2/20 0.54
TTK P33981 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 6/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 1/20 0.43
ASAH1 Q13510 1/20 0.43
HTT P42858 1/20 0.43
CSNK1D P48730 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
SCHEMBL6694919 0.89 TP53 (0.53) TP53LMNATDP1MEN1KMT2A
SCHEMBL6664702 0.86 TP53 (0.54) TP53LMNATDP1MAPTMEN1
SCHEMBL6703840 0.85 TP53 (0.53) TP53LMNATDP1MAPTMAPK1
SCHEMBL6705339 0.85 TP53 (0.44) TP53LMNATDP1MEN1KMT2A
SCHEMBL6699272 0.84 TP53 (0.51) TP53LMNATDP1MAPTMEN1
SCHEMBL6694288 0.84 TP53 (0.51) TP53TDP1MAPTHPGDALDH1A1
SCHEMBL6703136 0.84 TP53 (0.47) TP53LMNATDP1MEN1KMT2A
SCHEMBL6702873 0.84 TP53 (0.47) TP53LMNATDP1MEN1KMT2A
SCHEMBL6702887 0.83 MAPK1 (0.49) TP53LMNATDP1MAPTMEN1
SCHEMBL6700631 0.80 ALDH1A1 (0.46) TP53LMNATDP1MAPTMEN1

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-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP disclosed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 WO disclosed