SCHEMBL95213

SCHEMBL95213

COc1cc(N)c(N)c(C)n1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NNMT P40261 1/20 0.39
ALDH1A1 P00352 4/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PDE2A O00408 1/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
RECQL P46063 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
GRM4 Q14833 1/20 0.34
CYP1A2 P05177 2/20 0.33
PIK3CA P42336 1/20 0.33
CYP3A4 P08684 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL29839686 1.00 NNMT (0.39) NNMTALDH1A1NPC1RAB9APDE2A
SCHEMBL25393421 0.83 POLB (0.44) NNMTALDH1A1NPC1RAB9APDE2A
SCHEMBL22833435 0.79 TDO2 (0.39) NNMTALDH1A1NPC1RAB9APDE2A
SCHEMBL30294903 0.79 TDO2 (0.39) NNMTALDH1A1NPC1RAB9APDE2A
SCHEMBL1514960 0.78 POLB (0.44) ALDH1A1NPC1RAB9APDE2APOLB
SCHEMBL3452701 0.74 ALDH1A1 (0.35) ALDH1A1NPC1RAB9APDE2APOLB
SCHEMBL8016000 0.72 HTT (0.40) NNMTALDH1A1NPC1RAB9APOLB
SCHEMBL9383607 0.72 NCF1 (0.43) ALDH1A1POLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL9511107 0.72 NOS2 (0.42)
SCHEMBL29743795 0.71 NNMT (0.53) NNMTALDH1A1NPC1RAB9APDE2A

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 464 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
US-11918671-B2 Multi-tone hair dyeing method in three steps HENKEL AG & CO. KGAA (DE) 2024-03-05 US 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
CN-104853735-B For the autoxidizable reduction of the reagent of the oxidising dyeing and/or blast of keratin fiber 汉高股份有限及两合公司 2018-06-08 CN claimed
EP-2773429-B1 COLOR INTENSIFICATION BY POLYQUATERNIUM HENKEL AG & CO KGAA (DE) 2017-01-04 EP claimed
CN-104114540-B 1-hexyl-1H-pyrazoles-4,5-diamidogen Hemisulphate and the purposes in colouring compositions thereof 宝洁公司 2016-06-22 CN claimed
CN-104853735-A REDUCTION OF THE AUTOXIDATION OF AGENTS FOR THE OXIDATIVE DYEING AND/OR BLEACHING OF KERATIN FIBERS HENKEL AG & CO KGAA 2015-08-19 CN claimed
US-20140310888-A1 AGENT AND METHOD FOR COLORING KERATIN FIBERS GW COSMETICS GMBH (AT) 2014-10-23 US claimed
US-6203579-B1 MIXTURE OF ISATIN DERIVATIVE AND AMINO COMPOUND HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-03-20 US claimed
EP-0985406-B1 Hair dye composition GOLDWELL GMBH (DE) 2000-12-06 EP claimed
CN-1275071-A Dyeing composition containing pyrazolo-[1,5-alpha]-pyrimidine as oxidation base and pyridine coupling agent, and dyeing method OREAL (FR) 2000-11-29 CN claimed
EP-0615743-B1 Hair dyeing composition GOLDWELL GMBH (DE) 1999-11-03 EP claimed
EP-0791352-B1 Hair dyeing composition GOLDWELL GMBH (DE) 1999-09-08 EP claimed
EP-0857477-B1 Hair dye GOLDWELL GMBH (DE) 1999-07-21 EP claimed
EP-0818191-B1 Hairdying composition GOLDWELL GMBH (DE) 1999-03-17 EP claimed
EP-0818192-B1 Hair dyeing composition GOLDWELL GMBH (DE) 1998-11-04 EP claimed
EP-0857477-A1 Hair dye GOLDWELL GmbH (DE) 1998-08-12 EP claimed
EP-0818192-A1 Hair dyeing composition GOLDWELL GmbH (DE) 1998-01-14 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 NNMT 3549/4885ALDH1A1 2007/4885NPC1 4868/4885
US-11918671-B2 Multi-tone hair dyeing method in three steps TYR, HAO2, HAAO NNMT 440/4885ALDH1A1 111/4885NPC1 4487/4885

“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.