SCHEMBL3936770

SCHEMBL3936770

CN(/N=C/c1cccnc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.61
POLB P06746 1/20 0.61
MAPK1 P28482 1/20 0.61
NPC1 O15118 5/20 0.60
RAB9A P51151 5/20 0.60
SMN1; SMN2 Q16637 5/20 0.60
KDM4E B2RXH2 3/20 0.60
GAA P10253 1/20 0.60
G6PC1 P35575 1/20 0.57
ALDH1A1 P00352 4/20 0.55
LMNA P02545 3/20 0.55
CYP11B2 P19099 2/20 0.49
CYP11B1 P15538 1/20 0.49
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46

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
SCHEMBL3936772 1.00 MAPT (0.61) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL11288439 0.83 MAPT (0.64) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL8494526 0.82 MAPT (0.57) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL8494529 0.82 MAPT (0.57) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL10037535 0.81 MAPT (0.56) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL1131502 0.81 MAPT (0.56) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL1131506 0.81 MAPT (0.56) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL7662092 0.81 ALDH1A1 (0.62) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL7662089 0.81 ALDH1A1 (0.62) MAPTPOLBMAPK1NPC1RAB9A
SCHEMBL11494517 0.78 MAPT (0.58) MAPTPOLBMAPK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1847250-B1 Agents for colouring keratin fibres comprising zwitterionic azomethine dyes PROCTER & GAMBLE (US) 2009-12-23 EP disclosed
US-7513918-B2 Agents for coloring keratin fibers comprising zwitterionic azomethine dyes THE PROCTER & GAMBLE COMPANY (US) 2009-04-07 US disclosed
EP-1852104-A1 Agents for colouring keratin fibres comprising zwitterionic azomethine dyes Wella Aktiengesellschaft (DE) 2007-11-07 EP disclosed
WO-2007119228-A2 AGENTS FOR COLOURING KERATIN FIBRES COMPRISING ZWITTERIONIC AZOMETHINE DYES THE PROCTER & GAMBLE COMPANY (US) 2007-10-25 WO disclosed
US-20070245501-A1 Agents for coloring keratin fibers comprising zwitterionic azomethine dyes WELLA OPERATIONS US, LLC 2007-10-25 US disclosed
EP-1847250-A1 Agents for colouring keratin fibres comprising zwitterionic azomethine dyes Wella Aktiengesellschaft (DE) 2007-10-24 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070245501-A1 Agents for coloring keratin fibers comprising zwitterionic azomethine dyes KRT18, IK, RARG MAPT 3818/4885POLB 3692/4885MAPK1 1150/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.