SCHEMBL142002

SCHEMBL142002

Nc1ccc(S(=O)(=O)O)cc1S(=O)(=O)[O-].[Na+]

nearest known ligand 0.53

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
CA12 known ✓ O43570 1/20 0.40
CA1 known ✓ P00915 1/20 0.40
CA2 known ✓ P00918 1/20 0.40
P2RY12 known ✓ Q9H244 1/20 0.39
ALDH1A1 P00352 4/20 0.53
HSD17B10 Q99714 3/20 0.53
CASP6 P55212 3/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NT5E P21589 3/20 0.47
TSHR P16473 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
KDM4E B2RXH2 2/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
PKM P14618 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
SENP2 Q9HC62 2/20 0.41

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
SCHEMBL29702707 1.00 ALDH1A1 (0.53) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL8772805 0.86 LMNA (0.47) ALDH1A1HSD17B10CYP2C9CYP2C19TDP1
SCHEMBL142003 0.86 ALDH1A1 (0.59) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL153646 0.86 ALDH1A1 (0.59) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL342536 0.85 ALDH1A1 (0.58) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL29473550 0.85 ALDH1A1 (0.58) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL7064778 0.84 ALDH1A1 (0.57) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL28203178 0.84 ALDH1A1 (0.57) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
SCHEMBL142001 0.84 ALDH1A1 (0.57) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19
Water SCHEMBL29627107 0.83 ALDH1A1 (0.56) ALDH1A1HSD17B10CASP6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10468701-B2 Multi-acid polymers from multifunctional amino acids and sulfonyl halide precursors and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2019-11-05 US claimed
US-20170279145-A1 MULTI-ACID POLYMERS FROM MULTIFUNCTIONAL AMINO ACIDS AND SULFONYL HALIDE PRECURSORS AND METHODS OF MAKING THE SAME NISSAN MOTOR CO., LTD. (JP) 2017-09-28 US claimed
CN-113121392-B Aminobenzene sulfonic acid compound crystal particles and preparation method thereof 上海合丽亚化工科技有限公司 2022-06-10 CN disclosed
CN-113121392-A Aminobenzene sulfonic acid compound crystal particles and preparation method thereof 上海合丽亚化工科技有限公司 2021-07-16 CN disclosed
US-10930961-B2 Multi-acid polymers from multifunctional amino phosphonic acids and sulfonyl halide precursors and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2021-02-23 US disclosed
US-10468701-B2 Multi-acid polymers from multifunctional amino acids and sulfonyl halide precursors and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2019-11-05 US disclosed
US-20190013538-A1 Multi-Acid Polymers From Multifunctional Amino Acids and Sulfonyl Halide Precursors and Methods of Making the Same NISSAN MOTOR CO., LTD. (JP) 2019-01-10 US disclosed
US-10153505-B2 Multi-acid polymers from multifunctional amino acids and sulfonyl halide precursors and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2018-12-11 US disclosed
US-10035144-B2 Multi-acid polymers and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2018-07-31 US disclosed
US-9861977-B2 Multi-acid polymers and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2018-01-09 US disclosed
US-20170279144-A1 MULTI-ACID POLYMERS FROM MULTIFUNCTIONAL AMINO ACIDS AND SULFONYL HALIDE PRECURSORS AND METHODS OF MAKING THE SAME NISSAN MOTOR CO., LTD. (JP) 2017-09-28 US disclosed
US-20170274369-A1 Multi-Acid Polymers and Methods of Making the Same NISSAN MOTOR CO., LTD. (JP) 2017-09-28 US disclosed
US-20170274368-A1 MULTI-ACID POLYMERS AND METHODS OF MAKING THE SAME NISSAN MOTOR CO., LTD. (JP) 2017-09-28 US disclosed
US-20170279145-A1 MULTI-ACID POLYMERS FROM MULTIFUNCTIONAL AMINO ACIDS AND SULFONYL HALIDE PRECURSORS AND METHODS OF MAKING THE SAME NISSAN MOTOR CO., LTD. (JP) 2017-09-28 US disclosed
US-9694357-B1 Multi-acid polymers and methods of making the same NISSAN NORTH AMERICA, INC. (US) 2017-07-04 US disclosed
US-8679195-B2 Tanning process and tanning composition CLARIANT FINANCE (BVI) LIMITED (VG) 2014-03-25 US disclosed
EP-2430197-B1 TANNING PROCESS AND TANNING COMPOSITION CLARIANT FINANCE BVI LTD (VG) 2013-01-16 EP disclosed
EP-2430197-A1 TANNING PROCESS AND TANNING COMPOSITION Clariant Finance (BVI) Limited (VG) 2012-03-21 EP disclosed
US-20120058357-A1 Tanning Process and Tanning Composition CLARIANT FINANCE (BVI) LIMITED (VG) 2012-03-08 US disclosed
WO-2010130311-A1 TANNING PROCESS AND TANNING COMPOSITION CLARIANT INTERNATIONAL LTD (CH) 2010-11-18 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 (3 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-20170274368-A1 MULTI-ACID POLYMERS AND METHODS OF MAKING THE SAME FRS2, FXR2, PFAS CA12 777/4885CA1 2184/4885CA2 595/4885
US-10035144-B2 Multi-acid polymers and methods of making the same INSR, IAPP, SLC5A6 CA12 571/4885CA1 387/4885CA2 72/4885
US-20170274369-A1 Multi-Acid Polymers and Methods of Making the Same FRS2, PFAS, SOS2 CA12 1096/4885CA1 2101/4885CA2 587/4885

“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.