SCHEMBL691310

SCHEMBL691310

O=C(O)C1=C(c2ccc(S(=O)(=O)O)cc2)C(=O)N=N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.37
ALDH1A1 P00352 3/20 0.36
NT5E P21589 1/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PHLPP2 Q6ZVD8 2/20 0.35
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
CA14 Q9ULX7 2/20 0.34
ENPP2 Q13822 1/20 0.34
ADORA2B P29275 3/20 0.33

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
SCHEMBL691571 0.84 LCK (0.42) TSHRSMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL692424 0.80 ADORA2B (0.40) POLBCYP2D6TSHRSMN1; SMN2LMNA
SCHEMBL692332 0.80 TSHR (0.44) TSHRSMN1; SMN2ALDH1A1KDM4EHPGD
SCHEMBL30102143 0.79 CA1 (0.40) SMN1; SMN2LMNAALDH1A1KDM4ECA12
SCHEMBL691281 0.78 HSD17B10 (0.34) CYP2D6ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL692483 0.76 NAPRT (0.42) SMN1; SMN2LMNAALDH1A1KDM4EHPGD
SCHEMBL691486 0.76 RARB (0.35) TSHRLMNAALDH1A1KDM4ETDP1
SCHEMBL691551 0.75 LMNA (0.36) POLBCYP2D6TSHRSMN1; SMN2LMNA
SCHEMBL691425 0.74 CA2 (0.38) CA2CYP2C19
SCHEMBL691759 0.72 MCL1 (0.46) TSHRSMN1; SMN2LMNAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4247323-A2 GRANULATED HAIR DYE COMPOSITION Wella Germany GmbH (DE) 2023-09-27 EP disclosed
WO-2022106628-A2 GRANULATED HAIR DYE COMPOSITION WELLA GERMANY GMBH (DE) 2022-05-27 WO disclosed
EP-3512488-A1 HAIR COLOR COMPOSITIONS COMPRISING STABLE VIOLET-BLUE TO BLUE IMIDAZOLIUM DYES Noxell Corporation (US) 2019-07-24 EP disclosed
WO-2018053034-A1 HAIR COLOR COMPOSITIONS COMPRISING STABLE VIOLET-BLUE TO BLUE IMIDAZOLIUM DYES NOXELL CORPORATION (US) 2018-03-22 WO disclosed
WO-2018053096-A1 METHOD OF INCREASING UPTAKE AND WASHFASTNESS OF HAIR HEALTH COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2018-03-22 WO disclosed
EP-3270874-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES Noxell Corporation (US) 2018-01-24 EP disclosed
EP-3271026-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS Noxell Corporation (US) 2018-01-24 EP disclosed
EP-3271025-A1 METHOD OF COLORING HAIR WITH DIRECT DYE COMPOUNDS Noxell Corporation (US) 2018-01-24 EP disclosed
EP-3271027-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES Noxell Corporation (US) 2018-01-24 EP disclosed
WO-2016149429-A1 COMPOSITIONS FOR DYEING HAIR WITH CATIONIC DIRECT DYES THE PROCTER & GAMBLE COMPANY (US) 2016-09-22 WO disclosed
WO-2013122990-A1 1-HEXYL-1H-PYRAZOLE-4,5-DIAMINE HEMISULFATE, AND ITS USE IN DYEING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2013-08-22 WO disclosed
WO-2013085553-A2 OXIDATIVE DYEING COMPOSITIONS COMPRISING AN 1-HEXYL/HEPTYL-4,5-DIAMINOPYRAZOLE AND A BENZO[1,3]DIOXOL-5-YLAMINE AND DERIVATIVES THEREOF THE PROCTER & GAMBLE COMPANY (US) 2013-06-13 WO disclosed
WO-2013085554-A2 OXIDATIVE DYEING COMPOSITIONS COMPRISING AN 1-HEXYL/HEPTYL-4,5-DIAMINOPYRAZOLE AND A NAPHTHALEN-1-OL AND DERIVATIVES THEREOF THE PROCTER & GAMBLE COMPANY (US) 2013-06-13 WO disclosed
WO-2013058814-A1 OXIDATIVE DYEING COMPOSITIONS COMPRISING AN 1-HEXYL/HEPTYL-4,5-DIAMINOPYRAZOLE AND A BENZENE-1,3-DIOL AND DERIVATIVES THEREOF THE PROCTER & GAMBLE COMPANY (US) 2013-04-25 WO disclosed
WO-2013058815-A1 OXIDATIVE DYEING COMPOSITIONS COMPRISING AN 1-HEXYL/HEPTYL-4,5-DIAMINOPYRAZOLE AND A BENZENE-1,3-DIAMINE AND DERIVATIVES THEREOF THE PROCTER & GAMBLE COMPANY (US) 2013-04-25 WO disclosed
WO-2013058816-A1 OXIDATIVE DYEING COMPOSITIONS COMPRISING AN 1-HEXYL/HEPTYL-4,5-DIAMINOPYRAZOLE AND A 2-AMINOPHENOL AND DERIVATIVES THEREOF THE PROCTER & GAMBLE COMPANY (US) 2013-04-25 WO disclosed
WO-2012072634-A1 AZO DYES KEMIRA OYJ (FI) 2012-06-07 WO disclosed
EP-2421501-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF The Procter & Gamble Company (US) 2012-02-29 EP disclosed
WO-2010123863-A2 KERATIN DYEING COMPOSITIONS COMPRISING A RADICAL SCAVENGER AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2010-10-28 WO disclosed
WO-2003099937-A1 BISAZO AND TRISAZO COPPER COMPLEX DYESTUFFS CLARIANT INTERNATIONAL LTD (CH) 2003-12-04 WO disclosed