SCHEMBL1490963

SCHEMBL1490963

CCCCCCCCCCCCCCNCC(=O)[O-].[Na+]

nearest known ligand 0.54

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 10)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.52
FABP3 P05413 6/20 0.50
EPHX1 P07099 4/20 0.48
ALDH1A1 P00352 1/20 0.48
TSHR P16473 1/20 0.48
GPR84 Q9NQS5 1/20 0.47
S1PR2 O95136 1/20 0.46
S1PR4 O95977 1/20 0.46
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46

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
SCHEMBL1115447 1.00 CA1 (0.52) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL22534532 1.00 CA1 (0.52) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL6660469 1.00 CA1 (0.52) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL321998 0.98 CA1 (0.54) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL610050 0.96 ALDH1A1 (0.50) CA1FABP3EPHX1ALDH1A1TSHR
Dodicin SCHEMBL29987916 0.96 ALDH1A1 (0.50) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL11627739 0.96 FABP3 (0.50) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL10484717 0.96 FABP3 (0.50) CA1FABP3EPHX1ALDH1A1TSHR
Potassium Ion SCHEMBL6660182 0.96 FABP3 (0.53) CA1FABP3EPHX1ALDH1A1TSHR
SCHEMBL29543143 0.96 FABP3 (0.50) CA1FABP3EPHX1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115304712-A Preparation method and application of amphoteric styrene-butadiene latex 上海东升新材料有限公司 2022-11-08 CN claimed
EP-4525816-B1 WAX DISPERSIONS BASF SE (DE) 2026-05-20 EP disclosed
EP-4648740-A1 USE OF UNSATURATED FATTY ACID AMIDOPROPYL BETAINES AS THICKENERS BASF SE (DE) 2025-11-19 EP disclosed
US-20250302729-A1 Wax Dispersions BASF SE (DE) 2025-10-02 US disclosed
EP-4525816-A1 WAX DISPERSIONS BASF SE (DE) 2025-03-26 EP disclosed
CN-119212671-A Wax dispersion 巴斯夫欧洲公司 2024-12-27 CN disclosed
WO-2024149652-A1 BLENDS OF AMIDOPROPYL BETAINES DERIVED FROM FATTY ACID MIXTURES COMPRISING UNSATURATED FATTY ACIDS AND ALK(EN)YL (POLY)GLYCOSIDES BASF SE (DE) 2024-07-18 WO disclosed
WO-2024149654-A1 USE OF UNSATURATED FATTY ACID AMIDOPROPYL BETAINES AS THICKENERS BASF SE (DE) 2024-07-18 WO disclosed
US-20240000686-A1 PROCESS FOR PREPARING SURFACTANT SOLUTIONS WITH N-ACYL AMINO ACID SALTS BASF SE (DE) 2024-01-04 US disclosed
WO-2023222410-A1 WAX DISPERSIONS BASF SE (DE) 2023-11-23 WO disclosed
US-20160152555-A1 PROCESS FOR PREPARING N-ACYL AMINO ACID SALTS STEPAN CO (US) 2016-06-02 US disclosed
US-9156777-B2 Process for preparing N-acyl amino acid salts STEPAN COMPANY (US) 2015-10-13 US disclosed
EP-2870136-A1 PROCESS FOR PREPARING N-ACYL AMINO ACID SALTS Stepan Company (US) 2015-05-13 EP disclosed
US-20150126776-A1 PROCESS FOR PREPARING N-ACYL AMINO ACID SALTS STEPAN COMPANY 2015-05-07 US disclosed
WO-2015026538-A1 PROCESS FOR PREPARING N-ACYL AMINO ACID SALTS STEPAN COMPANY (US) 2015-02-26 WO disclosed
WO-2014008103-A1 PROCESS FOR PREPARING N-ACYL AMINO ACID SALTS STEPAN COMPANY (US) 2014-01-09 WO disclosed
US-8623809-B2 Pearlescent concentrate and process for production OTC GMBH (DE) 2014-01-07 US disclosed
EP-2470630-A2 PEARLESCENT CONCENTRATE AND METHOD FOR PRODUCING THE SAME OTC GmbH (DE) 2012-07-04 EP disclosed
US-20120149629-A1 PEARLESCENT CONCENTRATE AND PROCESS FOR PRODUCTION OTC GMBH (DE) 2012-06-14 US disclosed
WO-2011023803-A2 PEARLESCENT CONCENTRATE AND METHOD FOR PRODUCING THE SAME OTC GMBH (DE) 2011-03-03 WO 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 (2 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-20250302729-A1 Wax Dispersions CUTA, DSG1, CYP17A1 CA1 2882/4885FABP3 2227/4885EPHX1 1045/4885
US-20240000686-A1 PROCESS FOR PREPARING SURFACTANT SOLUTIONS WITH N-ACYL AMINO ACID SALTS CUTA, SMURF1, SMURF2 CA1 2883/4885FABP3 1084/4885EPHX1 2840/4885

“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.