SCHEMBL95141

SCHEMBL95141

Cc1cnc(CCN)c(O)c1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.41
HRH4 Q9H3N8 2/20 0.41
HRH2 P25021 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
AGXT P21549 1/20 0.36
LMNA P02545 1/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
NUDT1 P36639 1/20 0.33
TAAR1 Q96RJ0 4/20 0.32
HTR1D P28221 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL4865054 0.86 LMNA (0.38) AGXTLMNACCR1CCR5CCR8
SCHEMBL11707220 0.70 NOS3 (0.43) LMNACCR1CCR5CCR8NOS3
SCHEMBL14366752 0.70 AGXT (0.40) HRH1HRH4AGXTCCR1CCR5
SCHEMBL31184201 0.69 KDM4E (0.43) LMNACCR1CCR5CCR8CYP1A2
SCHEMBL3679226 0.69 KDM4E (0.43) LMNACCR1CCR5CCR8CYP1A2
SCHEMBL4483339 0.67 ALDH1A1 (0.38) AGXTLMNACCR1CCR5CCR8
SCHEMBL3564434 0.67 NUDT1 (0.42) HRH1HRH4HRH2HRH3TDP1
SCHEMBL9164063 0.66 CCR1 (0.38) CCR1CCR5CCR8NOS3NOS1
Ethylenediamine SCHEMBL6295958 0.66 CCR1 (0.38) HRH1HRH4AGXTLMNACCR1
SCHEMBL1758565 0.66 AGXT (0.40) AGXTCCR1CCR5CCR8NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-2658508-B2 TWO-PART HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2024-06-19 EP disclosed
EP-3427720-B1 AQUEOUS BLEACHING AND/OR DYEING COMPOSITION FOR KERATIN FIBERS, PROCESS, KIT AND USE THEREOF KAO GERMANY GMBH (DE) 2024-05-22 EP disclosed
EP-3427719-B1 AQUEOUS BLEACHING AND DYEING COMPOSITION FOR KERATIN FIBERS, PROCESS, KIT AND USE THEREOF KAO GERMANY GMBH (DE) 2024-03-06 EP disclosed
EP-2658513-B2 HAIR COLOURING COMPOSITION KAO GERMANY GMBH (DE) 2023-11-29 EP disclosed
EP-4051228-B1 TWO-PART OXIDATIVE DYEING COMPOSITION KAO CORP (JP) 2023-11-22 EP disclosed
WO-2023161423-A1 DYEING COMPOSITION IN AQUEOUS-ALCOHOLIC MEDIUM KAO CORPORATION (JP) 2023-08-31 WO disclosed
US-11737959-B2 Two-part oxidative dyeing composition KAO CORPORATION (JP) 2023-08-29 US disclosed
EP-3346978-B1 PROCESS FOR TREATING HAIR KAO GERMANY GMBH (DE) 2023-06-14 EP disclosed
EP-3485943-B1 PROCESS AND KIT FOR ALTERING COLOUR OF HAIR KAO GERMANY GMBH (DE) 2023-06-14 EP disclosed
US-20060174424-A1 Composition for dyeing human hair KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2006-08-10 US disclosed
EP-1676605-A1 Product for hair dyeing KPSS-Kao Professional Salon Services GmbH (DE) 2006-07-05 EP disclosed
EP-1645264-A1 Product for hair dyeing in a two chamber aerosol can KPSS-Kao Professional Salon Services GmbH (DE) 2006-04-12 EP disclosed
EP-1632218-A1 Composition for dyeing keratin fibres KPSS-Kao Professional Salon Services GmbH (DE) 2006-03-08 EP disclosed
EP-1627666-A1 Composition for dyeing keratin fibres KPSS-Kao Professional Salon Services GmbH (DE) 2006-02-22 EP disclosed
US-20050257334-A1 Composition for dyeing keratin fibers KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2005-11-24 US disclosed
US-20050257331-A1 Composition for dyeing of keratin fibres KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2005-11-24 US disclosed
EP-1598052-A1 Composition for bleaching and dyeing keratin fibres KPSS-Kao Professional Salon Services GmbH (DE) 2005-11-23 EP disclosed
EP-1559403-A1 Composition for dyeing human hair KPSS-Kao Professional Salon Services GmbH (DE) 2005-08-03 EP 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 (4 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-20060174424-A1 Composition for dyeing human hair CYB5R3, MT-ND5, COX5A HRH1 1745/4885HRH4 1267/4885HRH2 2192/4885
US-20050257331-A1 Composition for dyeing of keratin fibres KRT18, KCNH3, MT-CO3 HRH1 393/4885HRH4 109/4885HRH2 425/4885
US-11737959-B2 Two-part oxidative dyeing composition XDH, LPO, DUOX2 HRH1 884/4885HRH4 1707/4885HRH2 612/4885
US-20050257334-A1 Composition for dyeing keratin fibers KRT18, H1-5, CYB5R3 HRH1 321/4885HRH4 53/4885HRH2 522/4885

“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.