SCHEMBL6141554

SCHEMBL6141554

Cc1cc(N)ccc1NCc1cc(N)ccc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PDE10A Q9Y233 1/20 0.52
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
PRKCI P41743 1/20 0.47
ACHE P22303 3/20 0.46
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43
GAA P10253 3/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
EGFR P00533 1/20 0.40

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
Hydrochloric Acid SCHEMBL2976644 0.98 MAPT (0.54) MAPTSMN1; SMN2PDE10AMEN1KMT2A
Hydrochloric Acid SCHEMBL2984837 0.91 EGFR (0.50) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL7159228 0.88 MAPT (0.65) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL7156316 0.88 PDE10A (0.49) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL7158915 0.87 GAA (0.54) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL10848284 0.86 MAPT (0.71) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL6266347 0.83 MAPT (0.43) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL7161451 0.83 MAPT (0.51) MAPTSMN1; SMN2PDE10AMEN1KMT2A
SCHEMBL10955924 0.83 PRKCI (0.49) MAPTSMN1; SMN2PDE10AMEN1KMT2A
Hydrochloric Acid SCHEMBL6740118 0.82 MAPT (0.42) MAPTSMN1; SMN2PDE10AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1493731-A1 N-benzyl-p-phenylenediamine-derivatives containing colouring agents for keratin fibres and these derivatives Wella Aktiengesellschaft (DE) 2005-01-05 EP disclosed
EP-1226107-A1 N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES CONTAINING COLOURING AGENTS FOR KERATIN FIBRES AND NOVEL N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES Wella Aktiengesellschaft (DE) 2002-07-31 EP disclosed
WO-2002018318-A1 N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES CONTAINING COLOURING AGENTS FOR KERATIN FIBRES AND NOVEL N-BENZYL-P-PHENYLENEDIAMINE-DERIVATIVES WELLA AKTIENGESELLSCHAFT (DE) 2002-03-07 WO disclosed