SCHEMBL29370484

SCHEMBL29370484

CC(=O)N(C)c1ccc(Nc2cc(S(=O)(=O)[O-])c(N)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 7)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 known ✓ Q9H244 6/20 0.67
▸ P2RY2 known ✓ P41231 10/20 0.62
▸ P2RY4 known ✓ P51582 11/20 0.61
▸ P2RY1 known ✓ P47900 1/20 0.59
▸ P2RY6 known ✓ Q15077 1/20 0.59
▸ MET P08581 1/20 0.61
▸ CDK2 P24941 1/20 0.59

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
SCHEMBL2854183 0.89 P2RY2 (0.74) P2RY12P2RY2P2RY4METCDK2
SCHEMBL29439077 0.89 P2RY2 (0.74) P2RY12P2RY2P2RY4METCDK2
SCHEMBL29625851 0.81 P2RY4 (0.85) P2RY12P2RY2P2RY4METCDK2
SCHEMBL3911861 0.80 P2RY12 (0.68) P2RY12P2RY2P2RY4METCDK2
SCHEMBL3032350 0.80 P2RY4 (0.80) P2RY12P2RY2P2RY4METCDK2
SCHEMBL9173641 0.79 PHLPP2 (0.74) P2RY12P2RY2P2RY4METCDK2
SCHEMBL3032357 0.78 P2RY12 (0.77) P2RY12P2RY2P2RY4METCDK2
SCHEMBL3022506 0.77 P2RY12 (1.00) P2RY12P2RY2P2RY4METCDK2
SCHEMBL29356677 0.76 P2RY2 (1.00) P2RY12P2RY2P2RY4METCDK2
SCHEMBL3033638 0.76 P2RY12 (0.80) P2RY12P2RY2P2RY4METCDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4627027-A1 DETERGENT COMPARTMENT POUCH COMPRISING BIOSURFACTANTS Evonik Operations GmbH (DE) 2025-10-08 — — EP claimed
WO-2025149345-A1 LAUNDRY DETERGENT PRODUCT UNILEVER IP HOLDINGS B.V. (NL) 2025-07-17 — — WO claimed
CN-114981395-B Laundry detergent product 联合利华知识产权控股有限公司 2024-11-26 — — CN claimed
US-12012574-B2 Process for removing dry surface biofilm WHITELEY CORPORATION PTY. LTD. (AU) 2024-06-18 — — US claimed
WO-2024115213-A1 DETERGENT COMPARTMENT POUCH COMPRISING BIOSURFACTANTS EVONIK OPERATIONS GMBH (DE) 2024-06-06 — — WO claimed
US-20230407208-A1 LAUNDRY DETERGENT PRODUCT CONOPCO, INC., D/B/A UNILEVER (US) 2023-12-21 — — US claimed
EP-4097206-B1 LAUNDRY DETERGENT PRODUCT UNILEVER IP HOLDINGS B V (NL) 2023-08-09 — — EP claimed
US-11629311-B2 Enhanced solubilization using a combination of extended chain surfactants INDORAMA VENTURES OXIDES LLC (US) 2023-04-18 — — US claimed
EP-4097206-A1 LAUNDRY DETERGENT PRODUCT Unilever IP Holdings B.V. (NL) 2022-12-07 — — EP claimed
CN-115066484-A Laundry detergent product 联合利华知识产权控股有限公司 2022-09-16 — — CN claimed
CN-114981395-A Laundry detergent product 联合利华知识产权控股有限公司 2022-08-30 — — CN claimed
EP-3589777-B1 ALKALINE CLEANING COMPOSITIONS COMPRISING AN ALKYLAMINO HYDROXY ACID AND/OR SECONDARY AMINE AND METHODS OF REDUCING METAL CORROSION ECOLAB USA INC (US) 2026-05-20 — — EP disclosed
WO-2026102290-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS ECOLAB USA INC. (US) 2026-05-15 — — WO disclosed
US-20260125615-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS ECOLAB USA INC (US) 2026-05-07 — — US disclosed
EP-3936594-B1 FAST DRYING AND FAST DRAINING RINSE AID ECOLAB USA INC (US) 2026-04-29 — — EP disclosed
US-20220056369-A1 EFFICIENT SURFACTANT SYSTEM ON PLASTIC AND ALL TYPES OF WARE BASF SE (DE) 2022-02-24 — — US disclosed
US-11254897-B2 Hard surface cleaning compositions ECOLAB USA INC. (US) 2022-02-22 — — US disclosed
WO-2022026349-A1 A HARD SURFACE CLEANING CONCENTRATE PACKET DOW SILICONES CORPORATION (US) 2022-02-03 — — WO disclosed
US-20220033740-A1 STAIN REMOVAL THROUGH NOVEL OXIDIZER AND CHELANT COMBINATION ECOLAB USA INC. 2022-02-03 — — US disclosed
US-11236291-B2 Moderately alkaline cleaning compositions for proteinaceous and fatty soil removal at low temperatures ECOLAB USA INC. (US) 2022-02-01 — — US 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 (1 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-20260125615-A1 ENZYMATIC CAUSTIC FREE DETERGENT COMPOSITIONS FOR CLEANING DAIRY PROCESSING SYSTEMS CEL, PNLIP, CTRC P2RY12 3881/4885P2RY2 4164/4885P2RY4 4556/4885

“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.

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