SCHEMBL1045307

SCHEMBL1045307

Nc1ccc(-c2ccc(N)cc2-c2ncc[nH]2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.44
MTOR P42345 1/20 0.43
ADK P55263 1/20 0.43
DYRK1B Q9Y463 2/20 0.41
CSNK1A1 P48729 1/20 0.41
TYRO3 Q06418 1/20 0.41
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GLA P06280 2/20 0.40
MAPT P10636 2/20 0.40
RECQL P46063 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
GFER P55789 1/20 0.40
NTRK1 P04629 1/20 0.38

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
SCHEMBL32667989 0.82 CSNK1A1 (0.42) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL61086 0.81 NISCH (0.64) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL5248703 0.80 CSNK1A1 (0.44) NISCHMTORADKDYRK1BCSNK1A1
Hydrochloric Acid SCHEMBL8534775 0.80 NISCH (0.62) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL4063139 0.79 ALDH1A1 (0.41) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL31332460 0.79 CSNK1A1 (0.41) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL2650856 0.79 CSNK1A1 (0.44) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL8539151 0.79 CSNK1A1 (0.46) NISCHMTORADKDYRK1BCSNK1A1
Hydrochloric Acid SCHEMBL9756776 0.78 ALDH1A1 (0.46) NISCHMTORADKDYRK1BCSNK1A1
SCHEMBL15651168 0.77 NISCH (0.46) NISCHMTORADKDYRK1BCSNK1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101591299-B Side imidazolyl-containing benzidine derivatives and preparation method thereof UNIV SHANGHAI JIAOTONG 2011-05-04 CN claimed
CN-101591299-A Contain side imidazolyl benzidine derivative and preparation method thereof UNIV SHANGHAI JIAOTONG (CN) 2009-12-02 CN claimed
CN-101591299-B Side imidazolyl-containing benzidine derivatives and preparation method thereof UNIV SHANGHAI JIAOTONG 2011-05-04 CN disclosed
EP-2268710-A1 LARGE SCALE PROCESS FOR POLYMERIZATION OF 5 (6) -AMINO-2- (P-AMINOPHENYL) BENZIMIDAZOLE (DAPBI) CONTAINING POLYARAMID Teijin Aramid B.V. (NL) 2011-01-05 EP disclosed
CN-101591299-A Contain side imidazolyl benzidine derivative and preparation method thereof UNIV SHANGHAI JIAOTONG (CN) 2009-12-02 CN disclosed
CN-101591299-A Contain side imidazolyl benzidine derivative and preparation method thereof UNIV SHANGHAI JIAOTONG (CN) 2009-12-02 CN disclosed
CN-101591299-A Contain side imidazolyl benzidine derivative and preparation method thereof UNIV SHANGHAI JIAOTONG (CN) 2009-12-02 CN disclosed
WO-2009127586-A1 LARGE SCALE PROCESS FOR POLYMERIZATION OF 5 (6) -AMINO-2- (P-AMINOPHENYL) BENZIMIDAZOLE (DAPBI) CONTAINING POLYARAMID TEIJIN ARAMID B.V. (NL) 2009-10-22 WO disclosed