SCHEMBL6509350

SCHEMBL6509350

Nc1ccc(-c2nc3cc(-c4cccnc4)ccc3[nH]2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.69
HTT P42858 2/20 0.69
KDM4E B2RXH2 6/20 0.62
ALDH1A1 P00352 5/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
RAB9A P51151 5/20 0.62
NPC1 O15118 4/20 0.62
HPGD P15428 4/20 0.62
STAT1 P42224 1/20 0.62
LDHA P00338 1/20 0.57
EPHX2 P34913 1/20 0.57
MEN1 O00255 5/20 0.56
POLB P06746 4/20 0.56
KMT2A Q03164 4/20 0.56
GFER P55789 3/20 0.56
GLA P06280 3/20 0.56
GAA P10253 3/20 0.56
RXFP1 Q9HBX9 2/20 0.56
HSD17B10 Q99714 2/20 0.56
RECQL P46063 2/20 0.56

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
SCHEMBL3541175 0.87 MAPT (0.79) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL16499476 0.86 ALDH1A1 (0.65) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL417825 0.86 ALDH1A1 (0.71) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL9862039 0.85 ALDH1A1 (0.69) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL14837509 0.85 MAPT (0.60) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL14395420 0.83 ALDH1A1 (0.52) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL22906080 0.83 ALDH1A1 (0.58) MAPTKDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL6263502 0.83 ALDH1A1 (0.58) MAPTKDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL419961 0.83 MEN1 (0.77) MAPTHTTKDM4EALDH1A1SMN1; SMN2
SCHEMBL15245183 0.81 KDM4E (0.62) MAPTHTTKDM4EALDH1A1SMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005042496-A1 (BENZIMIDAZOL-2-YL)-PHENYL-BENZYL-AMINE DERIVATIVES AND METHODS FOR INHIBITING HEPARANASE ACTIVITY IMCLONE SYSTEMS INCORPORATED (US) 2005-05-12 WO disclosed