SCHEMBL458150

SCHEMBL458150

CCCc1c(N)ccc(N)c1CCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 2/20 0.45
SKP2 Q13309 1/20 0.40
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
GAA P10253 1/20 0.38
USP7 Q93009 1/20 0.34
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA2 P00918 1/20 0.33
S100B P04271 1/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 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
SCHEMBL2495189 0.88 NOS2 (0.52) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL27372846 0.88 SKP2 (0.47) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL1534142 0.88 NOS2 (0.38) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL814318 0.86 NOS2 (0.37) NOS2SKP2ALDH1A1KDM4EHPGD
Water SCHEMBL8332435 0.86 NOS2 (0.37) NOS2SKP2ALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL11386534 0.86 NOS2 (0.37) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL6573311 0.86 CNR1 (0.41) NOS2ALDH1A1KDM4EHPGDGAA
SCHEMBL3669925 0.86 NOS2 (0.37) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL10699613 0.84 NOS2 (0.36) NOS2SKP2ALDH1A1KDM4EHPGD
SCHEMBL5667505 0.84 NOS2 (0.48) NOS2SKP2ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112608516-B Multifunctional light-stable composition and preparation method thereof 沈阳化工研究院有限公司 2022-04-08 CN claimed
CN-112608516-A Multifunctional light-stable composition and preparation method thereof 沈阳化工研究院有限公司 2021-04-06 CN claimed
EP-3638200-A1 PROCESS FOR DYEING KERATIN MATERIALS USING AT LEAST ONE BLUE, PURPLE OR GREEN DYE AND AT LEAST ONE DISULFIDE, THIOL OR PROTECTED THIOL FLUORESCENT DYE L'Oreal (FR) 2020-04-22 EP claimed
CN-105916482-A Gradual hair color compositions and methods of use thereof 酷姆国际公司 2016-08-31 CN claimed
CN-105229015-A Zinc cluster compounds and their use as catalysts in the reaction of amines with dialkyl carbonates BAYER MATERIALSCIENCE AG 2016-01-06 CN claimed
US-20040194232-A1 Oxidizing composition and uses for dyeing, for permanently reshaping or for bleaching keratin fibers L'OREAL S.A. 2004-10-07 US claimed
US-20040010862-A1 Oxidation dyeing composition for keratinous fibres and dyeing method using same L'OREAL S.A. (FR) 2004-01-22 US claimed
CN-1440267-A Oxidation dyeing composition for keratinous fibres comprising amphoteric polymer with fatty chain OREAL (FR) 2003-09-03 CN claimed
CN-1236609-A Oxidation dyeing composition of keration fibre and dyeing method using same OREAL (FR) 1999-12-01 CN claimed
US-20240279089-A1 METHOD FOR CONTROLLING THE GROWTH OF MICROORGANISMS RED BULL GMBH (AT) 2024-08-22 US disclosed
EP-4112565-B1 METHOD OF CONTROLLING MICROORGANISM GROWTH RED BULL GMBH (AT) 2024-07-31 EP disclosed
WO-2024134667-A1 A DEVICE COMPRISING OXIDATIVE COMPOSITION FOR DYEING OF KERATIN FIBRES L'OREAL (FR) 2024-06-27 WO disclosed
EP-4363380-A1 METHOD FOR CONTROLLING THE GROWTH OF MICROORGANISMS Red Bull GmbH (AT) 2024-05-08 EP disclosed
WO-2023213211-A9 2,4-DISUBSTITUTED-5-FLUOROPYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND USE THEREOF 长沙晶易医药科技股份有限公司 2024-03-21 WO disclosed
EP-0589952-A1 USE OF SUPLHUROUS METAAMINOPHENOLS FOR DYING KERATINIC FIBRES, TINCTORIAL COMPOSITIONS AND NOVEL COMPOUNDS. OREAL (FR) 1994-04-06 EP disclosed
EP-0586660-A1 2-SULPHURED METAPHENYLENEDIAMINES FOR DYEING HAIR. OREAL (FR) 1994-03-16 EP disclosed
EP-0586648-A1 DYE COMPOSITION FOR KERATINIC FIBRES CONTAINING SULFURED METAPHENYLENEDIAMINES, DYEING PROCESS AND NEW SULFURED METAPHENYLENEDIAMINES AND PREPARATION METHOD THEREOF. OREAL (FR) 1994-03-16 EP disclosed
WO-1993020794-A1 METHOD FOR DYEING KERATIN FIBRES IN AN ALKALINE MEDIUM BY MEANS OF 2-SUBSTITUTED PARA-AMINOPHENOLS COMBINED WITH 6- OR 7-HYDROXYINDOLE, AND COMPOSITIONS THEREFOR L'OREAL (FR) 1993-10-28 WO disclosed
WO-1992022525-A1 USE OF SUPLHUROUS METAAMINOPHENOLS FOR DYING KERATINIC FIBRES, TINCTORIAL COMPOSITIONS AND NOVEL COMPOUNDS L'OREAL (FR) 1992-12-23 WO disclosed
CN-1063409-A Indole derivatives is done the application of colour former in the dyeing keratinous fibres process OREAL (FR) 1992-08-12 CN 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 (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-20040010862-A1 Oxidation dyeing composition for keratinous fibres and dyeing method using same KRT18, MT-ND5, COX5A NOS2 1772/4885SKP2 2328/4885ALDH1A1 180/4885
US-20040194232-A1 Oxidizing composition and uses for dyeing, for permanently reshaping or for bleaching keratin fibers KRT18, ALDH1A2, PPOX NOS2 625/4885SKP2 3426/4885ALDH1A1 179/4885

“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.