SCHEMBL78083

SCHEMBL78083

Nc1ccc(N)c([N+](=O)[O-])c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 1.00
TDP1 Q9NUW8 4/20 1.00
CYP3A4 P08684 2/20 1.00
ALOX15 P16050 2/20 1.00
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
MAPT P10636 4/20 0.69
TSHR P16473 3/20 0.69
POLB P06746 3/20 0.69
L3MBTL1 Q9Y468 2/20 0.64
RECQL P46063 1/20 0.64
MAPK1 P28482 1/20 0.64
HSD17B10 Q99714 1/20 0.64
LMNA P02545 1/20 0.58
PKM P14618 1/20 0.53
MCL1 Q07820 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL29358067 1.00 ALDH1A1 (1.00) ALDH1A1TDP1CYP3A4ALOX15MEN1
Hydrochloric Acid SCHEMBL1883446 0.98 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15MEN1
Hydrochloric Acid SCHEMBL3336452 0.98 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15MEN1
SCHEMBL23824901 0.98 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15MEN1
Methane SCHEMBL28048595 0.98 ALDH1A1 (0.96) ALDH1A1TDP1CYP3A4ALOX15MEN1
Hydrochloric Acid SCHEMBL28120789 0.96 ALDH1A1 (0.92) ALDH1A1TDP1CYP3A4ALOX15MEN1
Sulfuric Acid SCHEMBL1882494 0.90 ALDH1A1 (0.81) ALDH1A1TDP1CYP3A4ALOX15MEN1
Carbamic Acid SCHEMBL28268243 0.90 ALDH1A1 (0.81) ALDH1A1TDP1CYP3A4ALOX15MEN1
Propene SCHEMBL127283 0.89 ALDH1A1 (0.79) ALDH1A1TDP1CYP3A4ALOX15MEN1
SCHEMBL5489713 0.89 TDP1 (0.79) ALDH1A1TDP1CYP3A4ALOX15MEN1

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

Appears in 6816 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3723864-B1 THICKENED ONE-COMPONENT HAIR TONER HENKEL AG & CO KGAA (DE) 2026-01-14 EP claimed
US-12364660-B2 Granulated hair dye composition WELLA GERMANY GMBH (DE) 2025-07-22 US claimed
CN-114727916-B Hair treatment composition comprising oil containing olefinically unsaturated hydrocarbon 株式会社LG生活健康 2025-04-25 CN claimed
WO-2025061335-A1 METHOD FOR DYEING KERATIN FIBRES, COMPRISING THE APPLICATION OF AN OXIDATIVE PRE-TREATMENT AGENT AND A DYE COMPRISING DIRECT DYES HENKEL AG & CO. KGAA (DE) 2025-03-27 WO claimed
US-20240423887-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT KAO CORPORATION (JP) 2024-12-26 US claimed
EP-4247323-B1 GRANULATED HAIR DYE COMPOSITION WELLA GERMANY GMBH (DE) 2024-09-04 EP claimed
EP-4408376-A1 COMPOSITION COMPRISING A DYE AND INORGANIC ALKALIZING AGENT Kao Corporation (JP) 2024-08-07 EP claimed
CN-117165008-B Preparation process of flame-retardant plastic with thermal stability 佛山市索仕管道科技有限公司 2024-07-12 CN claimed
CN-112724349-B Polymer and use thereof 立邦涂料(中国)有限公司 2024-07-05 CN claimed
CN-112457484-B Particles comprising polyamides with in-backbone light absorbers and related methods 施乐公司 2024-06-25 CN claimed
EP-0008080-B1 HAIR DYEING COMPOSITION Wella Aktiengesellschaft (DE) 1981-07-01 EP claimed
EP-0012965-A1 Product and process for dyeing hair Wella Aktiengesellschaft (DE) 1980-07-09 EP claimed
WO-1980001241-A1 COMPOSITION AND PROCESS FOR HAIR COLOURATION WELLA AG (DE) 1980-06-26 WO claimed
WO-1980000303-A1 PREPARATION FOR HAIR COLORATION WELLA AG (DE) 1980-03-06 WO claimed
EP-0008080-A2 Hair dyeing composition Wella Aktiengesellschaft (DE) 1980-02-20 EP claimed
EP-0008039-A1 Hair dyeing composition containing 6-amino-3-methyl-phenol Wella Aktiengesellschaft (DE) 1980-02-20 EP claimed
US-4169853-A HYDROGENATION, CATALYST SELECTIVITY TEXACO DEVELOPMENT CORPORATION (US) 1979-10-02 US claimed
US-4104020-A OXIDIZABLE DEVELOPER-COUPLER HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1978-08-01 US claimed
US-4069206-A HYGROSCOPIC, PHOTOSENSITIVITY TEIJIN LIMITED (JA) 1978-01-17 US claimed
US-3981677-A Oxidative hair dye compositions containing N-substituted o-phenylenediamines and method for their use CLAIROL INCORPORATED (US) 1976-09-21 US claimed