SCHEMBL459936

SCHEMBL459936

Cc1n[nH]c(CCN)c1CCN

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MAPK1 P28482 1/20 0.37
AKT2 P31751 1/20 0.33
HRH4 Q9H3N8 4/20 0.32
HRH1 P35367 3/20 0.32
HTR1D P28221 1/20 0.32
TTR P02766 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
HRH2 P25021 3/20 0.31
CYP1A2 P05177 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
DYRK1A Q13627 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL5337870 0.80 MAPK1 (0.57) KDM4EMAPK1TTRSMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL1999396 0.78 KDM4E (0.60) KDM4EMAPK1TTRSMN1; SMN2MEN1
SCHEMBL15318187 0.77 MAPK1 (0.36) KDM4EMAPK1HRH4HRH1HTR1D
Hydrochloric Acid SCHEMBL6559450 0.77 KDM4E (0.40) KDM4EMAPK1HRH4HRH1HTR1D
SCHEMBL20339904 0.74 HCAR2 (0.43) KDM4EMAPK1SMN1; SMN2MEN1ALDH1A1
SCHEMBL6244436 0.74 KDM4E (0.42) KDM4EMAPK1TTRSMN1; SMN2LMNA
SCHEMBL6270622 0.71 KDM4E (0.33) KDM4EMAPK1
Oxalic Acid SCHEMBL7507025 0.71 KDM4E (0.47) KDM4EMAPK1TTRSMN1; SMN2MEN1
SCHEMBL7448538 0.71 LMNA (0.33) KDM4EMAPK1TTRMEN1ALDH1A1
SCHEMBL24157727 0.71 HCAR2 (0.41) KDM4EMAPK1SMN1; SMN2MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405627-B1 Antipenetrating hair pretreatment composition based on polyethelenoxide polymer(s) and process using said composition for limiting skin penetration by colourants OREAL (FR) 2008-04-30 EP claimed
EP-1292266-A2 NOVEL COUPLING COMPONENT FOR OXIDATIVE HAIR DYES Henkel Kommanditgesellschaft auf Aktien (DE) 2003-03-19 EP claimed
EP-1242038-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS Henkel Kommanditgesellschaft auf Aktien (DE) 2002-09-25 EP claimed
EP-1235550-A2 NEW COLOURING COMBINATION Henkel Kommanditgesellschaft auf Aktien (DE) 2002-09-04 EP claimed
US-20020040508-A1 COMPOSITION FOR DYEING KERATIN FIBRES,COMPRISING A PYRAZOLIN-4,5-DIONE AND AN AROMATIC PRIMARY AMINE L'OREAL S.A. (FR) 2002-04-11 US claimed
WO-2001097756-A2 NOVEL COUPLING COMPONENT FOR OXIDATIVE HAIR DYES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-12-27 WO claimed
WO-2001047475-A2 AGENT FOR DYEING KERATIN CONTAINING FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-07-05 WO claimed
WO-2001041717-A2 NEW COLOURING COMBINATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-14 WO claimed
WO-2024134667-A1 A DEVICE COMPRISING OXIDATIVE COMPOSITION FOR DYEING OF KERATIN FIBRES L'OREAL (FR) 2024-06-27 WO disclosed
EP-4362890-A1 COMPOSITION COMPRISING AT LEAST ONE OXIDATION DYE, AT LEAST ONE ALKALINE AGENT AND AT LEAST ONE LIQUID FATTY ALCOHOL AND AT LEAST ONE SOLID FATTY ALCOHOL L'OREAL (FR) 2024-05-08 EP disclosed
EP-4262718-A1 DYEING COMPOSITION BASED ON 2-GAMMA-HYDROXYPROPYL-PARA-PHENYLENEDIAMINE AND A PHOSPHORIC SURFACTANT L'OREAL (FR) 2023-10-25 EP disclosed
EP-4240311-A1 COMPOSITION FOR KERATIN FIBERS L'OREAL (FR) 2023-09-13 EP disclosed
WO-2023118332-A1 COMPOSITION COMPRISING TWO POLYOLS DIFFERENT FROM ONE ANOTHER, AN ALKALINE AGENT AND A DYE L'OREAL (FR) 2023-06-29 WO disclosed
WO-2023275197-A1 COMPOSITION COMPRISING AT LEAST ONE OXIDATION DYE, AT LEAST ONE ALKALINE AGENT AND AT LEAST ONE LIQUID FATTY ALCOHOL AND AT LEAST ONE SOLID FATTY ALCOHOL L'OREAL (FR) 2023-01-05 WO disclosed
WO-2001074319-A1 ENCYMATICAL COLORANT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-10-11 WO disclosed
US-6254646-B1 ENZYME OF 2-ELECTRON OXIDOREDUCTASE TYPE IN THE PRESENCE OF AT LEAST ONE DONOR FOR THE SAID ENZYME, AND AMINOSILICONE, HAIR DYE, PERMANENT WAVING L'OREAL S.A. (FR) 2001-07-03 US disclosed
WO-2001045655-A1 SOLID COLORANT FOR KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-28 WO disclosed
WO-2001045647-A2 METHOD FOR TABLETTING THICKENING SYSTEMS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-28 WO disclosed
WO-2001045653-A1 SOLID COLORANT FOR KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-28 WO disclosed
WO-2001041716-A2 COLOURING COMBINATION BASED ON A M-PHENYLENEDIAMINE DERIVATIVE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-06-14 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-20020040508-A1 COMPOSITION FOR DYEING KERATIN FIBRES,COMPRISING A PYRAZOLIN-4,5-DIONE AND AN AROMATIC PRIMARY AMINE KRT18, KLK5, H1-5 KDM4E 292/4885MAPK1 1861/4885AKT2 4778/4885

“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.