SCHEMBL4667375

SCHEMBL4667375

Cc1c(N)cccc1Nc1ccc(N)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
PIK3CA P42336 1/20 0.41
NUDT1 P36639 1/20 0.39
KEAP1 Q14145 1/20 0.38
MAPK10 P53779 2/20 0.37
MAPT P10636 4/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
APP P05067 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
SNCA P37840 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 1/20 0.35
PTGS1 P23219 2/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34

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
SCHEMBL4068824 0.80 MAPK10 (0.50) PIK3CAMAPK10SMN1; SMN2MEN1KMT2A
SCHEMBL5242624 0.76 CYP3A4 (0.62) CYP3A4TSHRPIK3CANUDT1MAPT
Hydrochloric Acid SCHEMBL10587715 0.75 POLB (0.35) NUDT1KEAP1MAPTKDM4EHPGD
SCHEMBL20796132 0.74 FTO (0.46) MAPTKDM4ETP53HPGDSMN1; SMN2
SCHEMBL30202244 0.74 FTO (0.46) MAPTKDM4ETP53HPGDSMN1; SMN2
SCHEMBL4667363 0.74 MAPT (0.66) CYP3A4TSHRPIK3CAMAPTKDM4E
SCHEMBL3160018 0.73 GRIN2D (0.37) MAPK10MAPTKDM4EALDH1A1PTGS1
SCHEMBL4070837 0.71 HPGD (0.52) PIK3CAMAPK10MAPTHPGDSMN1; SMN2
SCHEMBL16621270 0.71 MAPK10 (0.51) CYP3A4TSHRPIK3CANUDT1MAPK10
SCHEMBL2180838 0.70 CYP3A4 (0.43) CYP3A4TSHRPIK3CANUDT1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1982748-A2 Novel hair colouring compositions for use in oxidative hair dyeing The Procter & Gamble (US) 2008-10-22 EP claimed
US-7303592-B2 Hair coloring compositions for use in oxidative hair dyeing THE PROCTER & GAMBLE COMPANY (US) 2007-12-04 US claimed
EP-1855644-A2 HAIR COLORING COMPOSITIONS FOR USE IN OXIDATIVE HAIR DYEING The Procter and Gamble Company (US) 2007-11-21 EP claimed
WO-2006099115-A2 HAIR COLORING COMPOSITIONS FOR USE IN OXIDATIVE HAIR DYEING THE PROCTER & GAMBLE COMPANY (US) 2006-09-21 WO claimed
US-20050188480-A1 Novel hair coloring compositions for use in oxidative hair dyeing WELLA OPERATIONS US, LLC 2005-09-01 US claimed
EP-1982748-A2 Novel hair colouring compositions for use in oxidative hair dyeing The Procter & Gamble (US) 2008-10-22 EP disclosed
EP-1982749-A2 Novel hair colouring compositions for use in oxidative hair dyeing The Procter and Gamble Company (US) 2008-10-22 EP disclosed
US-7303592-B2 Hair coloring compositions for use in oxidative hair dyeing THE PROCTER & GAMBLE COMPANY (US) 2007-12-04 US disclosed
EP-1855644-A2 HAIR COLORING COMPOSITIONS FOR USE IN OXIDATIVE HAIR DYEING The Procter and Gamble Company (US) 2007-11-21 EP disclosed
WO-2006099115-A2 HAIR COLORING COMPOSITIONS FOR USE IN OXIDATIVE HAIR DYEING THE PROCTER & GAMBLE COMPANY (US) 2006-09-21 WO disclosed
US-20050188480-A1 Novel hair coloring compositions for use in oxidative hair dyeing WELLA OPERATIONS US, LLC 2005-09-01 US 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-20050188480-A1 Novel hair coloring compositions for use in oxidative hair dyeing COXFA4L2, TYR, GPX4 CYP3A4 310/4885TSHR 3768/4885PIK3CA 3717/4885

“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.