SCHEMBL839312

SCHEMBL839312

Cc1ccn(C)c(=O)[n+]1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
KDM6A O15550 1/20 0.38
KDM4A O75164 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM5C P41229 1/20 0.38
KDM2B Q8NHM5 1/20 0.38
DOHH Q9BU89 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
CRBN Q96SW2 1/20 0.35
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
BRD4 O60885 1/20 0.31
TAF1 P21675 1/20 0.31
BRPF1 P55201 1/20 0.31
CREBBP Q92793 1/20 0.31
CECR2 Q9BXF3 1/20 0.31
BRD9 Q9H8M2 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 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
Hydrochloric Acid SCHEMBL3119373 0.98 KDM4E (0.36) KDM4EKDM6AKDM4ACYP2C9CYP2C19
Sulfuric Acid SCHEMBL3398193 0.87 KDM4E (0.34) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL1923338 0.76 KDM4E (0.36) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL2525810 0.73 LPO (0.35) KDM4EAPOBEC3AAPOBEC3GMAPT
SCHEMBL839103 0.64 ALOX15 (0.30)
SCHEMBL1277062 0.63
Hydrochloric Acid SCHEMBL8672192 0.61 SMN1; SMN2 (0.38) KDM4ELMNAMAPTSMN1; SMN2L3MBTL1
Water SCHEMBL22654522 0.61 ACHE (0.35) KDM4ELMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL13367986 0.60
Hydrochloric Acid SCHEMBL3171274 0.59 HDAC8 (0.38) KDM4EAPOBEC3AAPOBEC3GL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2358343-B1 METHOD FOR DECOLOURING KERATINOUS FIBRES HENKEL AG & CO KGAA (DE) 2016-10-19 EP claimed
EP-1965753-B1 REVERSIBLY CHANGEABLE HAIR COLOR HENKEL AG & CO KGAA (DE) 2013-09-04 EP claimed
US-8268015-B2 Method for decolorizing keratin-containing fibers HENKEL AG & CO. KGAA (DE) 2012-09-18 US claimed
EP-1778176-B1 COMPOSITION FOR COLOURING KERATIN-CONTAINING FIBRES HENKEL AG & CO KGAA (DE) 2012-07-25 EP claimed
US-20110247644-A1 Method for Decolorizing Keratin-Containing Fibers HENKEL AG & CO. KGAA (DE) 2011-10-13 US claimed
US-7799096-B2 Agent for dyeing keratin-containing fibers HENKEL AG & CO. KGAA (DE) 2010-09-21 US claimed
US-20100064450-A1 AGENT FOR DYEING KERATIN-CONTAINING FIBERS HENKEL AG & CO. KGAA (DE) 2010-03-18 US claimed
US-7678156-B2 Compositions for treating keratinic fibers, methods of treating such fibers therewith and compounds contained therein HENKEL AG & CO. KGAA (DE) 2010-03-16 US claimed
US-20100037909-A1 SUBSTANCES FOR DYEING KERATINOUS FIBERS HENKEL AG & CO. KGAA (DE) 2010-02-18 US claimed
EP-1796627-B1 AGENT FOR COLOURING FIBRES CONTAINING KERATIN HENKEL AG & CO KGAA (DE) 2009-03-04 EP claimed
EP-2018844-A2 Agent for dying fibres which contain keratin comprising derivatives of naphthaldehyde in combination with CH acidic compounds Henkel AG & Co. KGaA (DE) 2009-01-28 EP claimed
EP-2014275-A2 Kit for preparing storage-stable formulations Henkel AG & Co. KGaA (DE) 2009-01-14 EP claimed
US-7473280-B2 Coloring agent compositions and methods of treating keratin fibers therewith HENKEL KGAA (DE) 2009-01-06 US claimed
US-20080301885-A1 REVERSIBLY CHANGEABLE HAIR COLOR HENKEL AG & CO. KGAA (DE) 2008-12-11 US claimed
US-20080189877-A1 Mixture of quaternized imidazo[1,5-a]pyrimidinium derivate and benzaldehyde derivative; cationic hair dyes, oxidation color dyes; colorfastness, washfastness HENKEL KGAA (DE) 2008-08-14 US claimed
US-7393367-B2 Agent for dyeing keratin-based fibers HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-07-01 US claimed
US-20080104772-A1 AGENT FOR DYEING KERATIN-BASED FIBERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-08 US claimed
EP-1789014-B1 SUBSTANCE FOR DYEING KERATINIC FIBERS HENKEL KGAA (DE) 2008-02-27 EP claimed
US-20070287686-A1 Substance for Dyeing Keratinic Fibers HENKEL KGAA (DE) 2007-12-13 US claimed
EP-1534227-B1 AGENTS USED FOR DYEING KERATINOUS FIBERS HENKEL KGAA (DE) 2006-12-27 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 (7 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-20110247644-A1 Method for Decolorizing Keratin-Containing Fibers KRT18, PLOD3, DSG1 KDM4E 508/4885KDM6A 101/4885KDM4A 498/4885
US-20080104772-A1 AGENT FOR DYEING KERATIN-BASED FIBERS KRT18, KAT5, H1-5 KDM4E 1661/4885KDM6A 580/4885KDM4A 1062/4885
US-20070287686-A1 Substance for Dyeing Keratinic Fibers KRT18, SCNN1B, COL1A1 KDM4E 615/4885KDM6A 457/4885KDM4A 470/4885
US-20100064450-A1 AGENT FOR DYEING KERATIN-CONTAINING FIBERS KRT18, CRYAA, CKAP4 KDM4E 1842/4885KDM6A 463/4885KDM4A 1045/4885
US-20100037909-A1 SUBSTANCES FOR DYEING KERATINOUS FIBERS KRT18, H1-10, COL1A1 KDM4E 1659/4885KDM6A 788/4885KDM4A 778/4885
US-20080301885-A1 REVERSIBLY CHANGEABLE HAIR COLOR TYR, CBR3, COXFA4L2 KDM4E 707/4885KDM6A 366/4885KDM4A 535/4885
US-20080189877-A1 Mixture of quaternized imidazo[1,5-a]pyrimidinium derivate and benzaldehyde derivative; cationic hair dyes, oxidation color dyes; colorfastness, washfastness TYR, NDUFS5, WASHC5 KDM4E 1235/4885KDM6A 1150/4885KDM4A 783/4885

“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.