SCHEMBL7560149

SCHEMBL7560149

Cc1cc(NCc2ccc(N)cc2)ccc1N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 3/20 0.51
LMNA P02545 3/20 0.51
CYP3A4 P08684 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
ALDH1A1 P00352 5/20 0.45
TDP1 Q9NUW8 3/20 0.45
THRB P10828 3/20 0.45
ALOX15 P16050 3/20 0.45
RECQL P46063 1/20 0.45
HIF1A Q16665 1/20 0.45
KDM4E B2RXH2 4/20 0.43
GAA P10253 3/20 0.43
POLB P06746 2/20 0.43
MEN1 O00255 4/20 0.42

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
SCHEMBL6260266 0.87 ALDH1A1 (0.63) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL13829230 0.87 KCNQ3 (0.54) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL6141577 0.86 MAPT (0.45) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL2991374 0.86 HTT (0.58) MAPTNPC1RAB9ALMNACYP3A4
Hydrochloric Acid SCHEMBL2990361 0.85 ALDH1A1 (0.61) MAPTNPC1RAB9ALMNACYP3A4
Hydrochloric Acid SCHEMBL2983000 0.85 MAPT (0.44) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL3093725 0.83 FFAR1 (0.48) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL30794377 0.82 PTPN1 (0.48) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL6005423 0.82 PTPN1 (0.48) MAPTNPC1RAB9ALMNACYP3A4
SCHEMBL6259291 0.82 PTPRF (0.57) MAPTLMNACYP3A4CYP1A2CYP2D6

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-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