SCHEMBL692123

SCHEMBL692123

Nc1cc(CC(=O)C(O)CO)ccc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.46
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.43
MAPT P10636 6/20 0.43
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
ADRB2 P07550 1/20 0.37
RECQL P46063 1/20 0.36
SIRT6 Q8N6T7 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL10316763 0.81 TDP1 (0.50) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL31510411 0.81 TDP1 (0.50) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL4857085 0.80 TDP1 (0.53) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL4857095 0.80 TDP1 (0.53) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL572190 0.78 TDP1 (0.58) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL692126 0.77 TDP1 (0.46) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL29902882 0.75 TSHR (0.47) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL6209939 0.75 ALDH1A1 (0.61) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL9316883 0.74 TDP1 (0.62) TDP1TSHRMAPK1MAPTLMNA
SCHEMBL692125 0.74 MAPT (0.43) TDP1TSHRMAPK1MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2658511-B1 DYEING COMPOSITION FOR KERATIN FIBERS KAO GERMANY GMBH (DE) 2018-04-04 EP claimed
EP-2547315-B1 COLOURING COMPOSITION FOR KERATIN FIBRES KAO GERMANY GMBH (DE) 2017-07-05 EP claimed
US-8709102-B2 Dyeing composition for keratin fibers KAO GERMANY GMBH (DE) 2014-04-29 US claimed
US-20130255008-A1 DYEING COMPOSITION FOR KERATIN FIBERS KAO GERMANY GMBH (DE) 2013-10-03 US claimed
US-8523956-B2 Colouring composition for keratin fibres KAO GERMANY GMBH (DE) 2013-09-03 US claimed
WO-2013061477-A1 HAIR COLORATION BY THERMAL TRANSFER TECHNOLOGY L'OREAL (FR) 2013-05-02 WO claimed
EP-2547315-A1 COLOURING COMPOSITION FOR KERATIN FIBRES Kao Germany GmbH (DE) 2013-01-23 EP claimed
US-20130000056-A1 COLOURING COMPOSITION FOR KERATIN FIBRES KAO GERMANY GMBH (DE) 2013-01-03 US claimed
EP-2468245-A1 Dyeing composition for keratin fibers KPSS-Kao Professional Salon Services GmbH (DE) 2012-06-27 EP claimed
WO-2011113452-A1 COLOURING COMPOSITION FOR KERATIN FIBRES KPSS-KAO PROFESSIONAL SALON SERVICES GMBH (DE) 2011-09-22 WO claimed
EP-2226065-A2 Colouring composition for keratin fibres KPSS-Kao Professional Salon Services GmbH (DE) 2010-09-08 EP claimed
US-7419656-B2 Mixture containing phenylenediamine compound KAO CORPORATION (JP) 2008-09-02 US claimed
US-20250381317-A1 COLLAGEN COMPOSITIONS AND METHODS OF USE THEREOF MODERN MEADOW INC (US) 2025-12-18 US disclosed
US-12133906-B2 Delivery particle THE PROCTER & GAMBLE COMPANY (US) 2024-11-05 US disclosed
CN-118806618-A Hair cleansing compositions 日本乐敦制药株式会社 2024-10-22 CN disclosed
CN-111201009-B Hair cleansing compositions 日本乐敦制药株式会社 2024-08-16 CN disclosed
WO-2003029359-A1 CATIONIC REACTIVE DYES CIBA SPECIALTY CHEMICALS HOLDINGS INC. (CH) 2003-04-10 WO disclosed
EP-1291006-A1 HAIR BLEACH OR HAIR DYE Kao Corporation (JP) 2003-03-12 EP disclosed
US-20020139957-A1 Hair bleach composition and hair dye composition KAO CORPORATION (JP) 2002-10-03 US disclosed
EP-1219285-A2 Hair bleach composition and hair dye composition Kao Corporation (JP) 2002-07-03 EP 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 (4 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-20130255008-A1 DYEING COMPOSITION FOR KERATIN FIBERS KRT18, AKR1B10, AKR7A2 TDP1 2685/4885TSHR 4623/4885MAPK1 1651/4885
US-20020139957-A1 Hair bleach composition and hair dye composition OR10J3, LBR, POLL TDP1 2560/4885TSHR 2455/4885MAPK1 2398/4885
US-12133906-B2 Delivery particle LIPA, CHMP4B, SLC46A1 TDP1 2392/4885TSHR 4380/4885MAPK1 4819/4885
US-20130000056-A1 COLOURING COMPOSITION FOR KERATIN FIBRES KRT18, MDN1, CUTA TDP1 2949/4885TSHR 4678/4885MAPK1 355/4885

“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.