SCHEMBL10037535

SCHEMBL10037535

CN(/N=C\c1ccncc1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.56
SMN1; SMN2 Q16637 9/20 0.56
NPC1 O15118 7/20 0.56
RAB9A P51151 7/20 0.56
KDM4E B2RXH2 4/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
G6PC1 P35575 2/20 0.54
ALDH1A1 P00352 5/20 0.52
KMT2A Q03164 11/20 0.50
MEN1 O00255 10/20 0.50
HPGD P15428 1/20 0.50
LMNA P02545 2/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
TDP1 Q9NUW8 3/20 0.46
ALOX12 P18054 2/20 0.46
MCL1 Q07820 1/20 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
SCHEMBL1131502 1.00 MAPT (0.56) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL1131506 1.00 MAPT (0.56) MAPTSMN1; SMN2NPC1RAB9AKDM4E
Sulfuric Acid Dimethyl Ester SCHEMBL27752564 0.87 SMN1; SMN2 (0.46) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8494526 0.87 MAPT (0.57) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL8494529 0.87 MAPT (0.57) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL5681841 0.86 MAPT (0.48) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL5681840 0.86 MAPT (0.48) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL13909197 0.83 MAPT (0.47) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL3936770 0.81 MAPT (0.61) MAPTSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL3936772 0.81 MAPT (0.61) MAPTSMN1; SMN2NPC1RAB9AKDM4E

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-2235115-B1 POLYMERIC HAIR DYES BASF SE (DE) 2013-10-16 EP disclosed
US-8097045-B2 Polymeric hair dyes BASF SE (DE) 2012-01-17 US disclosed
US-8097045-B2 Polymeric hair dyes BASF SE (DE) 2012-01-17 US disclosed
US-20110107525-A1 POLYMERIC HAIR DYES BASF SE (US) 2011-05-12 US disclosed
US-20110107525-A1 POLYMERIC HAIR DYES BASF SE (US) 2011-05-12 US disclosed
WO-2009090125-A1 POLYMERIC HAIR DYES BASF SE (DE) 2009-07-23 WO 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-20110107525-A1 POLYMERIC HAIR DYES CYB5R3, CYC1, CBR1 MAPT 3936/4885SMN1; SMN2 3347/4885NPC1 1263/4885

“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.