SCHEMBL9853282

SCHEMBL9853282

COc1ccc(Nc2cccc(C)c2)cc1Nc1cccc(C)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
KMT2A Q03164 5/20 0.55
MEN1 O00255 4/20 0.55
CASP3 P42574 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
EGFR P00533 2/20 0.51
GAA P10253 1/20 0.50
AKR1C3 P42330 2/20 0.49
AKR1C2 P52895 2/20 0.49
TP53 P04637 1/20 0.46
ERBB3 P21860 1/20 0.46
ALDH1A1 P00352 4/20 0.46
STAT3 P40763 1/20 0.45
IMPDH2 P12268 1/20 0.44
HPGD P15428 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 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
SCHEMBL8943948 0.84 NPSR1 (0.51) MAPTKMT2AMEN1CASP3SENP7
SCHEMBL30145137 0.78 NPSR1 (0.86) MAPTKMT2AMEN1NPSR1EGFR
SCHEMBL1922070 0.78 NPSR1 (0.86) MAPTKMT2AMEN1NPSR1EGFR
SCHEMBL10523964 0.78 NPSR1 (0.86) MAPTKMT2AMEN1NPSR1EGFR
SCHEMBL29650380 0.78 NPSR1 (0.86) MAPTKMT2AMEN1NPSR1EGFR
SCHEMBL1009206 0.78 NPSR1 (0.86) MAPTKMT2AMEN1NPSR1EGFR
SCHEMBL11085812 0.77 NPSR1 (0.66) MAPTKMT2AMEN1NPSR1GAA
SCHEMBL7150730 0.77 MEN1 (0.62) MAPTKMT2AMEN1CASP3SENP7
SCHEMBL11762089 0.76 CYP1A2 (0.50) NPSR1EGFRALDH1A1
SCHEMBL9185679 0.76 NPSR1 (0.58) MAPTKMT2AMEN1NPSR1EGFR

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
EP-0455247-A2 m-Phenylenediamine compound and electrophotosensitive material using said compound MITA INDUSTRIAL CO. LTD. (JP) 1991-11-06 EP disclosed