SCHEMBL530600

SCHEMBL530600

Nc1ccc(NCCO)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
TDO2 P48775 1/20 0.43
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAP4K4 O95819 4/20 0.42
CLK4 Q9HAZ1 4/20 0.42
MINK1 Q8N4C8 3/20 0.42
TYK2 P29597 2/20 0.42
SRPK1 Q96SB4 1/20 0.42
HRH4 Q9H3N8 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
NUDT1 P36639 1/20 0.41
JAK2 O60674 3/20 0.41
CLK2 P49760 3/20 0.41
DYRK1A Q13627 3/20 0.41
ROCK2 O75116 2/20 0.41
GSK3B P49841 2/20 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
SCHEMBL29007934 0.89 NUDT1 (0.54) KDM4EALDH1A1POLBGAAHRH4
SCHEMBL30417616 0.89 NUDT1 (0.54) KDM4EALDH1A1POLBGAAHRH4
SCHEMBL11252790 0.88 HRH4 (0.45) ALDH1A1POLBHRH4HRH3HCAR3
SCHEMBL30639140 0.88 HRH4 (0.45) ALDH1A1POLBHRH4HRH3HCAR3
SCHEMBL2028729 0.82 HRH3 (0.42) HRH4HRH3HCAR3PTGS1PRKD3
Hydrochloric Acid SCHEMBL5694428 0.81 HRH3 (0.41) HRH4HRH3HCAR3PTGS1PRKD3
SCHEMBL29618390 0.81 HCAR3 (0.56) ALDH1A1HRH4HRH3HCAR3PTGS1
SCHEMBL2911978 0.81 HCAR3 (0.56) ALDH1A1HRH4HRH3HCAR3PTGS1
SCHEMBL7353325 0.81 APP (0.42) HRH4HRH3HCAR3PTGS1FTO
SCHEMBL11264344 0.79 PTGS1 (0.40) HRH4HRH3HCAR3PTGS1FTO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2024-12-26 US claimed
EP-4408376-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2024-08-07 EP claimed
CN-118043022-A Composition comprising a dye and an inorganic alkalizing agent 花王株式会社 2024-05-14 CN claimed
WO-2023054558-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2023-04-06 WO claimed
EP-4159184-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2023-04-05 EP claimed
EP-1963313-B1 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE (DGAT) MADRIGAL PHARMACEUTICALS INC (US) 2012-11-14 EP claimed
EP-1963313-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE (DGAT) F.HOFFMANN-LA ROCHE AG (CH) 2008-09-03 EP claimed
WO-2007060140-A2 INHIBITORS OF DIACYGLYCEROL ACYLTRANSFERASE (DGAT) F. HOFFMANN-LA ROCHE AG (CH) 2007-05-31 WO claimed
EP-1250912-B1 Hair dye composition KPSS KAO GMBH (DE) 2004-09-15 EP claimed
EP-1297818-A2 Hair dye KPSS-Kao Professional Salon Services GmbH (DE) 2003-04-02 EP claimed
EP-1250912-A1 Hair dye composition GOLDWELL GmbH (DE) 2002-10-23 EP claimed
US-5180399-A Kits for dyeing hair L'OREAL (FR) 1993-01-19 US claimed
US-4588410-A DEVELOPERS, COUPLERS WELLA AKTIENGESELLSCHAFT (DE) 1986-05-13 US claimed
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2024-12-26 US disclosed
CN-118804737-A Dyeing composition in aqueous alcohol medium 花王株式会社 2024-10-18 CN disclosed
EP-4408376-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2024-08-07 EP disclosed
US-4950302-A Process for the production of 2,5-diamino-6-nitro-pyridine derivatives, their use in hair dye compositions and new 2,5-diamino-6-nitropyridine derivatives WELLA AKTIENGESELLSCHAFT (DE) 1990-08-21 US disclosed
EP-0303878-A2 2,5-diamino-nitro-6-pyridine derivatives containing hair dyeing agents Wella Aktiengesellschaft (DE) 1989-02-22 EP disclosed
EP-0257399-A2 Hair dyeing composition Beratungslabor für die kosmetische und pharmazeutische Industrie Dipl.-Ing. Karlheinz Schrader (DE) 1988-03-02 EP disclosed
US-4588410-A DEVELOPERS, COUPLERS WELLA AKTIENGESELLSCHAFT (DE) 1986-05-13 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-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KRT18, COL14A1, COL1A1 KDM4E 1590/4885ALDH1A1 2007/4885POLB 139/4885

“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.