SCHEMBL6653675

SCHEMBL6653675

Cc1ccc(NO)cc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.50
▸ CYP1A2 P05177 3/20 0.49
▸ CYP2D6 P10635 3/20 0.49
▸ CYP2C9 P11712 3/20 0.49
▸ CYP2C19 P33261 3/20 0.49
▸ CYP3A4 P08684 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ TSHR P16473 1/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ ACHE P22303 1/20 0.45
▸ TRPA1 O75762 1/20 0.45
▸ PTGS1 P23219 1/20 0.45
▸ CACNA1C Q13936 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ HSD17B2 P37059 2/20 0.42
▸ TUBB4A P04350 1/20 0.42
▸ TUBB P07437 1/20 0.42

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
SCHEMBL3963262 0.81 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11414048 0.80 POLB (0.54) ALDH1A1CYP1A2GAAKMT2ANPC1
SCHEMBL14465086 0.79 TSHR (0.52) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL16280191 0.77 TSHR (0.50) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11405325 0.77 ARG1 (0.50) TRPA1ALOX15
SCHEMBL3962037 0.76 ALDH1A1 (0.54) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL2853227 0.76 ALDH1A1 (0.64) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL453729 0.76 TRPA1 (0.50) ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL11404540 0.74 KMT2A (0.50) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL11408434 0.74 RAPGEF4 (0.55) ALDH1A1CYP3A4MEN1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118043024-A Solid composition for dyeing keratin 花王株式会社 2024-05-14 — — CN disclosed
CN-102166163-B Hair treatment agent composition and method for production thereof NONOGAWA SHOJI LTD. (JP) 2014-10-29 — — CN disclosed
CN-102166163-A Hair treatment agent composition and method for production thereof NONOGAWA SHOJI LTD 2011-08-31 — — CN disclosed
CN-1599590-A Hair treatment agent composition and method for producing same NONOGAWA SHOJI LTD (JP) 2005-03-23 — — CN disclosed
EP-1430873-A1 HAIR TREATMENT AGENT COMPOSITION AND METHOD FOR PRODUCTION THEREOF Nonogawa Shoji Ltd. (JP) 2004-06-23 — — EP disclosed
US-6695888-B2 COMPLEX TRANSITION METAL HAIR DYE UNILEVER HOME & PERSONAL CARE, USA, DIVISION OF CONOPCO, INC. 2004-02-24 — — US disclosed
WO-2004014328-A1 ONE STEP HAIR COLORING COMPOSITIONS COMPRISING WATER SOLUBLE CARBONATE RELEASING SALTS UNILEVER PLC (GB) 2004-02-19 — — WO disclosed
US-20040019980-A1 One step hair coloring compositions using salts UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-02-05 — — US disclosed
WO-2003047542-A1 HAIR BLEACHING AND COLOURING COMPOSITION WHICH COMPRISE TRASITION METAL CATALYSTS UNILEVER PLC (GB) 2003-06-12 — — WO disclosed
US-20030066140-A1 Transition metal complexes as dye forming catalysts in hair coloring compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-04-10 — — US disclosed
WO-2003011237-A2 TRANSITION METAL COMPLEXES AS DYE FORMING CATALYSTS IN HAIR COLORING COMPOSITIONS UNILEVER PLC (GB) 2003-02-13 — — WO disclosed
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