SCHEMBL4665722

SCHEMBL4665722

Nc1ccc(Nc2cc(N)ccn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.64
SCN5A Q14524 1/20 0.64
SCN9A Q15858 1/20 0.64
MAPK10 P53779 4/20 0.50
RAD52 P43351 1/20 0.50
MAPK14 Q16539 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43
ALOX12 P18054 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.43
EGFR P00533 1/20 0.42
ROCK1 Q13464 4/20 0.42
BCL6 P41182 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL26186466 0.87 MAPK10 (0.69) KCNH2SCN5ASCN9AMAPK10MAPK14
SCHEMBL30368352 0.87 MAPK10 (0.69) KCNH2SCN5ASCN9AMAPK10MAPK14
SCHEMBL24010544 0.86 KCNH2 (0.58) KCNH2SCN5ASCN9AMAPK10RAD52
SCHEMBL30216764 0.86 KCNH2 (0.58) KCNH2SCN5ASCN9AMAPK10L3MBTL1
SCHEMBL23588551 0.86 KCNH2 (0.58) KCNH2SCN5ASCN9AMAPK10L3MBTL1
SCHEMBL20796123 0.77 KCNH2 (0.45) KCNH2SCN5ASCN9AMAPK10MAPK14
SCHEMBL21281931 0.77 ROCK1 (0.57) KCNH2SCN5ASCN9AALDH1A1MAPT
SCHEMBL22086809 0.76 KCNH2 (0.47) KCNH2SCN5ASCN9AMAPK10ALDH1A1
SCHEMBL29590223 0.76 MEN1 (0.55) MAPK10RAD52L3MBTL1ALDH1A1CYP1A2
SCHEMBL3888498 0.76 MEN1 (0.55) MAPK10RAD52L3MBTL1ALDH1A1CYP1A2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1982749-B1 Novel hair colouring compositions for use in oxidative hair dyeing PROCTER & GAMBLE (US) 2013-04-17 EP claimed
EP-1982749-A2 Novel hair colouring compositions for use in oxidative hair dyeing The Procter and Gamble Company (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
US-11441075-B2 Liquid crystal alignment agent composition, method of producing liquid crystal alignment film using the same, and liquid crystal alignment film using the same LG CHEM, LTD. (KR) 2022-09-13 US disclosed
US-11307462-B2 Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film using same, and liquid crystal alignment film and liquid crystal display using same LG CHEM, LTD. (KR) 2022-04-19 US disclosed
US-11209699-B2 Liquid crystal aligning agent composition, method for preparing liquid crystal alignment film using same, and liquid crystal alignment film using same LG CHEM, LTD. (KR) 2021-12-28 US disclosed
US-11149204-B2 Liquid crystal alignment agent composition, method for preparing liquid crystal alignment film using same, and liquid crystal alignment film and liquid crystal display using same LG CHEM, LTD. (KR) 2021-10-19 US disclosed
US-11118113-B2 2021-09-14 US disclosed
US-20210139780-A1 POLYMER FOR LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT AGENT COMPRISING THE SAME, AND LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME LG CHEM, LTD. (KR) 2021-05-13 US disclosed
US-20210130694-A1 LIQUID CRYSTAL ALIGNING AGENT COMPOSITION, METHOD FOR PREPARING LIQUID CRYSTAL ALIGNMENT FILM USING SAME, AND LIQUID CRYSTAL ALIGNMENT FILM USING SAME LG CHEM, LTD. (KR) 2021-05-06 US disclosed
EP-1982749-B1 Novel hair colouring compositions for use in oxidative hair dyeing PROCTER & GAMBLE (US) 2013-04-17 EP disclosed
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 KCNH2 1434/4885SCN5A 435/4885SCN9A 1395/4885

“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.