SCHEMBL29350751

SCHEMBL29350751

Cc1ccc(Nc2ccc(Nc3ccc(C)cc3S(=O)(=O)[O-])c3c2C(=O)c2ccccc2C3=O)c(S(=O)(=O)[O-])c1.[Na+].[Na+]

nearest known ligand 0.67

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY4 known ✓ P51582 10/20 0.67
P2RY2 known ✓ P41231 8/20 0.67
P2RY12 known ✓ Q9H244 6/20 0.60
P2RY6 known ✓ Q15077 1/20 0.57
THRB known ✓ P10828 2/20 0.55
P2RY1 known ✓ P47900 2/20 0.55
MET P08581 2/20 0.57
CDK2 P24941 1/20 0.56
MEN1 O00255 2/20 0.55
NSD2 O96028 2/20 0.55
ALDH1A1 P00352 2/20 0.55
POLB P06746 2/20 0.55
MAPT P10636 2/20 0.55
HPGD P15428 2/20 0.55
MAPK1 P28482 2/20 0.55
RECQL P46063 2/20 0.55
KMT2A Q03164 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
TDP1 Q9NUW8 2/20 0.55

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
SCHEMBL126076 1.00 P2RY4 (0.67) P2RY4P2RY2P2RY12METP2RY6
Hydrochloric Acid SCHEMBL30808003 0.99 P2RY4 (0.65) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29637834 0.95 P2RY4 (0.61) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL30106754 0.95 P2RY4 (0.61) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL30311409 0.93 P2RY4 (0.59) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29354251 0.93 P2RY4 (0.59) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL185515 0.93 P2RY4 (0.59) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL2343041 0.92 P2RY4 (0.58) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29375867 0.90 P2RY4 (0.56) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL2861363 0.90 P2RY4 (0.56) P2RY4P2RY2P2RY12METP2RY6

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 2576 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026089856-A1 METHOD OF PREPARING AND USING A SKIN CARE FORMULATION DOW SILICONES CORPORATION (US) 2026-04-30 WO claimed
WO-2026089857-A1 METHOD OF PREPARING AND USING A SKIN CARE COMPOSITION DOW SILICONES CORPORATION (US) 2026-04-30 WO claimed
US-12576026-B2 Formulations of nebivolol EXTROVIS AG (CH) 2026-03-17 US claimed
EP-4701618-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF A SHAMPOO Henkel AG & Co. KGaA (DE) 2026-03-04 EP claimed
EP-4701617-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF AN AFTERTREATMENT AGENT CONTAINING PROTEIN HYDROLYSATE AND/OR AMINO ACID Henkel AG & Co. KGaA (DE) 2026-03-04 EP claimed
EP-4061326-B1 PERSONAL CARE COMPOSITION COMPRISING A MULTISTAGE POLYMER DOW GLOBAL TECHNOLOGIES LLC (US) 2026-02-25 EP claimed
EP-3723864-B1 THICKENED ONE-COMPONENT HAIR TONER HENKEL AG & CO KGAA (DE) 2026-01-14 EP claimed
EP-4398865-B1 MAKEUP KIT COMPRISING AN AQUEOUS MAKEUP COMPOSITION AND A CONTINUOUS OILY-PHASE FIXING COMPOSITION WITH A HYDROPHOBIC FILM-FORMING POLYMER OREAL (FR) 2025-10-29 EP claimed
US-12453690-B2 Aqueous suncare formulation DOW GLOBAL TECHNOLOGIES LLC (US) 2025-10-28 US claimed
EP-4216910-B1 SKIN CARE FORMULATION DOW GLOBAL TECHNOLOGIES LLC (US) 2025-09-17 EP claimed
US-11331258-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, an oligoalkylsiloxane and a dyeing compound HENKEL AG & CO. KGAA (DE) 2022-05-17 US claimed
US-20220143251-A1 Device and Related Compositions and Methods for Use in Surface Decontamination KINNOS INC (US) 2022-05-12 US claimed
EP-3989920-A1 ADDITIVES FOR COLORING AGENTS AND METHODS OF USE THEREOF Living Proof, Inc. (US) 2022-05-04 EP claimed
CN-114388077-A Traditional Chinese medicine dyed material database based on micro-focusing Raman technology and application thereof in identification of traditional Chinese medicine dyed materials 成都市食品药品检验研究院 2022-04-22 CN claimed
CN-109715777-B Apparatus for surface decontamination and related compositions and methods 金诺斯公司 2022-04-19 CN claimed
CN-114341325-A Solid detergent composition 联合利华知识产权控股有限公司 2022-04-12 CN claimed
US-11291622-B2 Method for dyeing keratinous material, comprising the use of an organosilicon compound, a dyeing compound and a silicon oil HENKEL AG & CO. KGAA (DE) 2022-04-05 US claimed
WO-2022066592-A1 SKIN CARE FORMULATION DOW GLOBAL TECHNOLOGIES LLC (US) 2022-03-31 WO claimed
CN-114222555-A Additives for colorants and methods of use thereof 生活实验公司 2022-03-22 CN claimed
US-11234910-B2 Capsules comprising pigments, and method for producing same AMOREPACIFIC CORPORATION (KR) 2022-02-01 US claimed