SCHEMBL6896833

SCHEMBL6896833

Nc1ccc([N+](=O)[O-])cc1NCCO

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.62
TDP1 Q9NUW8 6/20 0.59
TSHR P16473 2/20 0.59
ALDH1A1 P00352 8/20 0.55
PKM P14618 2/20 0.50
KAT2B Q92831 1/20 0.50
THRB P10828 3/20 0.49
GAA P10253 2/20 0.49
MEN1 O00255 5/20 0.48
KDM4E B2RXH2 2/20 0.48
MAPT P10636 5/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP3A4 P08684 2/20 0.46
GFER P55789 1/20 0.46
ATM Q13315 1/20 0.46
ALOX15 P16050 1/20 0.45

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
SCHEMBL108393 0.89 KMT2A (0.65) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL29390080 0.89 KMT2A (0.65) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL29390514 0.87 KMT2A (0.70) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL126989 0.87 KMT2A (0.70) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL8749218 0.84 KMT2A (0.62) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL8107530 0.83 MAPT (0.54) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL113357 0.83 KMT2A (0.61) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL110398 0.83 KAT2B (0.68) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL16210843 0.81 KMT2A (0.63) KMT2ATDP1TSHRALDH1A1PKM
SCHEMBL563763 0.81 PKM (0.67) KMT2ATDP1TSHRALDH1A1PKM

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12178897-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations HENKEL AG & CO. KGAA (DE) 2024-12-31 US disclosed
US-12109291-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations HENKEL AG & CO. KGAA (DE) 2024-10-08 US disclosed
US-12102704-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations HENKEL AG & CO. KGAA (DE) 2024-10-01 US disclosed
US-12097274-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations HENKEL AG & CO. KGAA (DE) 2024-09-24 US disclosed
US-20230310296-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations HENKEL AG & CO. KGAA (DE) 2023-10-05 US disclosed
US-20230270647-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations HENKEL AG & CO. KGAA (DE) 2023-08-31 US disclosed
US-20230270649-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations HENKEL AG & CO. KGAA (DE) 2023-08-31 US disclosed
WO-2023163907-A1 OXIDATIVE DYEING AGENT FOR KERATIN FIBERS COMPRISING NOVEL DYE PRECURSOR COMBINATIONS HENKEL AG & CO. KGAA (DE) 2023-08-31 WO disclosed
WO-2023163903-A1 OXIDATIVE DYEING AGENT FOR KERATIN FIBERS COMPRISING NOVEL DYE PRECURSOR COMBINATIONS HENKEL AG & CO. KGAA (DE) 2023-08-31 WO disclosed
WO-2023163906-A1 OXIDATIVE DYEING AGENT FOR KERATIN FIBERS COMPRISING NOVEL DYE PRECURSOR COMBINATIONS HENKEL AG & CO. KGAA (DE) 2023-08-31 WO disclosed
WO-2023163908-A1 OXIDATIVE DYEING AGENT FOR KERATIN FIBERS COMPRISING NOVEL DYE PRECURSOR COMBINATIONS HENKEL AG & CO. KGAA (DE) 2023-08-31 WO disclosed
US-20230270648-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations HENKEL AG & CO. KGAA (DE) 2023-08-31 US disclosed
EP-1235673-A4 METHOD OF FORMING A MEMBRANE, ESPECIALLY A LATEX OR POLYMER MEMBRANE, INCLUDING MULTIPLE DISCRETE LAYERS BIO BARRIER INC (US) 2004-04-28 EP disclosed
EP-1235673-A2 METHOD OF FORMING A MEMBRANE, ESPECIALLY A LATEX OR POLYMER MEMBRANE, INCLUDING MULTIPLE DISCRETE LAYERS Bio Barrier, Inc. (US) 2002-09-04 EP disclosed
WO-1999020203-A2 METHOD OF FORMING A MEMBRANE, ESPECIALLY A LATEX OR POLYMER MEMBRANE, INCLUDING MULTIPLE DISCRETE LAYERS BIO BARRIER, INC. (US) 1999-04-29 WO disclosed
US-4702863-A Indoaniline and indophenol compounds, a process for their preparation, dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1987-10-27 US 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 (8 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-12109291-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations KRT18, ALDH5A1, ALDH2 KMT2A 2250/4885TDP1 1560/4885TSHR 4836/4885
US-20230270647-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations KRT18, ALDH5A1, COX5A KMT2A 2897/4885TDP1 1004/4885TSHR 4771/4885
US-20230270649-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations KRT18, ALDH5A1, COX5A KMT2A 2049/4885TDP1 1430/4885TSHR 4846/4885
US-20230270648-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations KRT18, ALDH5A1, ALDH2 KMT2A 1974/4885TDP1 1390/4885TSHR 4819/4885
US-12102704-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations KRT18, ALDH5A1, ALDH2 KMT2A 1974/4885TDP1 1390/4885TSHR 4819/4885
US-12097274-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations KRT18, ALDH5A1, COX5A KMT2A 2897/4885TDP1 1004/4885TSHR 4771/4885
US-20230310296-A1 Oxidative Dyeing Agent For Keratin Fibers Comprising Novel Dye Precursor Combinations KRT18, ALDH5A1, ALDH2 KMT2A 2250/4885TDP1 1560/4885TSHR 4836/4885
US-12178897-B2 Oxidative dyeing agent for keratin fibers comprising novel dye precursor combinations KRT18, ALDH5A1, COX5A KMT2A 2049/4885TDP1 1430/4885TSHR 4846/4885

“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.