SCHEMBL45337

SCHEMBL45337

Nc1ccccc1N[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
CA9 Q16790 2/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 3/20 0.43
GAA P10253 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HDAC1 Q13547 5/20 0.41
HDAC3 O15379 4/20 0.41
HDAC2 Q92769 4/20 0.41
MAPK1 P28482 2/20 0.41
RORC P51449 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALOX15 P16050 2/20 0.41
TP53 P04637 1/20 0.41

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
Benzene SCHEMBL6151758 0.98 MAPT (0.47) MAPTCA9ALDH1A1KDM4EGAA
Sulfuric Acid SCHEMBL7865188 0.91 CA9 (0.49) MAPTCA9ALDH1A1KDM4EGAA
SCHEMBL6852072 0.74 RAB9A (0.47) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL30335 0.74 NPC1 (0.49) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL31374378 0.74 MAPK1 (0.49) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL7208909 0.74 MAPK1 (0.49) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL950729 0.74 MAPK1 (0.60) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL11045869 0.74 MEN1 (0.43) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL2333439 0.74 HSD17B10 (0.48) MAPTALDH1A1KDM4EGAAKMT2A
SCHEMBL9517965 0.72 L3MBTL1 (0.42) MAPTALDH1A1MEN1KMT2ALMNA

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 1550 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240148629-A1 HAIR COLORING COMPOSITIONS L'OREAL (FR) 2024-05-09 US claimed
US-11730694-B1 Hair coloring compositions and methods L'OREAL (FR) 2023-08-22 US claimed
US-11382851-B2 Hair dye composition containing at least one organic silicon compound, a direct dye and a film forming hydrophobic polymer HENKEL AG & CO. KGAA (DE) 2022-07-12 US claimed
CN-114727916-A Hair treatment composition comprising oil containing olefinic unsaturated hydrocarbon 株式会社LG生活健康 2022-07-08 CN claimed
US-20210361551-A1 AGENT FOR DYEING HAIR, CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A COLORING COMPOUND AND A FILM-FORMING, HYDROPHILIC POLYMER HENKEL AG & CO. KGAA (DE) 2021-11-25 US claimed
EP-3873416-A1 METHOD FOR TREATING HAIR, COMPRISING THE APPLICATION OF A FIRST AGENT (A) HAVING A SILANE AND A CHROMOPHORIC COMPOUND, AND A SECOND AGENT (B) HAVING A FILM-FORMING POLYMER Henkel AG & Co. KGaA (DE) 2021-09-08 EP claimed
EP-3873402-A1 METHOD FOR TREATING HAIR, COMPRISING THE APPLICATION OF AN ORGANIC SILICON COMPOUND, AN ALKALISING AGENT AND A FILM-FORMING POLYMER Henkel AG & Co. KGaA (DE) 2021-09-08 EP claimed
US-20210186841-A1 HAIR DYE COMPOSITION CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A DIRECT DYE AND A FILM FORMING HYDROPHOBIC POLYMER HENKEL AG & CO. KGAA (DE) 2021-06-24 US claimed
WO-2021096093-A1 COMPOSITION FOR HAIR TREATMENT, CONTAINING OLEFIN-BASED UNSATURATED HYDROCARBON-CONTAINING OIL 주식회사 엘지생활건강 2021-05-20 WO claimed
EP-3790630-A1 AGENT FOR DYEING HAIR, CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A COLORING COMPOUND AND A FILM-FORMING, HYDROPHILIC POLYMER Henkel AG & Co. KGaA (DE) 2021-03-17 EP claimed
EP-0480829-B1 Hair dyeing composition containing anthraquinones OREAL (FR) 1994-04-06 EP claimed
US-5298029-A Hair dyes CLAIROL INCORPORATED (US) 1994-03-29 US claimed
US-5226924-A 1,4-DI(MONO- OR POLY) HYDROXYALKYLAMINO-9,10-ANTHRAQUINONES FOR DYEING HUMAN KERATINOUS FIBRES, COSMETIC COMPOSITION CONTAINING THEM IN COMBINATION WITH AZO AND NITROBENZENE DYES, AND HAIR-DYEING PROCESS USING THEM L'OREAL (FR) 1993-07-13 US claimed
US-5110318-A Clay-based hair conditioners and coloring agents TIRO INDUTRIES, INC. A CORP. OF MN 1992-05-05 US claimed
EP-0480829-A1 Hair dyeing composition containing anthraquinones L'OREAL (FR) 1992-04-15 EP claimed
US-4875902-A HAIR DYES L'OREAL (FR) 1989-10-24 US claimed
US-4834768-A HAIR DYES L'OREAL (FR) 1989-05-30 US claimed
US-4828568-A N-(2,4-DIHYDROXYBENZYLIDENE)AMINO COMPOUNDS AS PRIMARY COUPLERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-05-09 US claimed
US-4764174-A Nitrophenylenediamine dye composition having improved deposition on human hair and wool HELENE CURTIS, INC. (US) 1988-08-16 US claimed
US-4289495-A HAIR DYES, STORAGE STABILITY L'OREAL (FR) 1981-09-15 US 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 (5 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-20240148629-A1 HAIR COLORING COMPOSITIONS PLIN5, GK, PLIN3 MAPT 4097/4885CA9 3189/4885ALDH1A1 227/4885
US-20210361551-A1 AGENT FOR DYEING HAIR, CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A COLORING COMPOUND AND A FILM-FORMING, HYDROPHILIC POLYMER CUTA, KRT18, DSG1 MAPT 1599/4885CA9 246/4885ALDH1A1 356/4885
US-11382851-B2 Hair dye composition containing at least one organic silicon compound, a direct dye and a film forming hydrophobic polymer KRT18, DSG1, CUTA MAPT 1057/4885CA9 244/4885ALDH1A1 354/4885
US-20210186841-A1 HAIR DYE COMPOSITION CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A DIRECT DYE AND A FILM FORMING HYDROPHOBIC POLYMER KRT18, DSG1, CUTA MAPT 1057/4885CA9 244/4885ALDH1A1 354/4885
US-11730694-B1 Hair coloring compositions and methods AGPS, UGT8, ALPG MAPT 2728/4885CA9 1001/4885ALDH1A1 360/4885

“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.