SCHEMBL2326423

SCHEMBL2326423

CCCCCCCCCCCCc1cc2ccccc2c(S(=O)(=O)[O-])c1CCCC.[Na+]

nearest known ligand 0.43

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
MAPT P10636 3/20 0.43
TLR8 Q9NR97 4/20 0.39
FUT7 Q11130 1/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 2/20 0.36
GAA P10253 2/20 0.35
LIPG Q9Y5X9 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CTSV O60911 1/20 0.35
CTSL P07711 1/20 0.35
USP2 O75604 1/20 0.35
GLA P06280 1/20 0.35

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
SCHEMBL9192312 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18140853 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141388 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139671 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141747 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141275 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141645 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL1109611 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139114 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139726 0.99 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11623972-B2 Substituted catechol monomers, copolymers and methods for use RHODIA OPERATIONS (FR) 2023-04-11 US disclosed
US-11613597-B2 Substituted catechol polymeric dispersants RHODIA OPERATIONS (FR) 2023-03-28 US disclosed
CN-109312009-B Latex for improved water resistance without high performance surfactants 罗地亚经营管理公司 2022-01-07 CN disclosed
EP-3844227-A1 SUBSTITUTED CATECHOL POLYMERIC DISPERSANTS RHODIA OPERATIONS (FR) 2021-07-07 EP disclosed
EP-3844139-A1 SUBSTITUTED CATECHOL MONOMERS, COPOLYMERS AND METHODS FOR USE RHODIA OPERATIONS (FR) 2021-07-07 EP disclosed
US-20200071441-A1 SUBSTITUTED CATECHOL MONOMERS, COPOLYMERS AND METHODS FOR USE RHODIA OPERATIONS (FR) 2020-03-05 US disclosed
WO-2020047372-A1 SUBSTITUTED CATECHOL MONOMERS, COPOLYMERS AND METHODS FOR USE RHODIA OPERATIONS (FR) 2020-03-05 WO disclosed
WO-2020047377-A1 SUBSTITUTED CATECHOL POLYMERIC DISPERSANTS RHODIA OPERATIONS (FR) 2020-03-05 WO disclosed
US-20200071442-A1 SUBSTITUTED CATECHOL POLYMERIC DISPERSANTS RHODIA OPERATIONS (FR) 2020-03-05 US disclosed
EP-3119819-B1 TRI-SUBSTITUTED AROMATIC-CONTAINING MONOMERS, COPOLYMERS AND METHODS FOR USE RHODIA OPERATIONS (FR) 2020-01-29 EP disclosed
WO-2014100181-A1 COMPOSITIONS WITH PH RESPONSIVE COPOLYMER CONTAINING MAEP AND/OR MAHP AND METHODS FOR USING SAME RHODIA OPERATIONS (FR) 2014-06-26 WO disclosed
US-20140178324-A1 Compositions with pH Responsive Copolymer Containing MAEP and/or MAHP and Method for Using Same RHODIA OPERATIONS (FR) 2014-06-26 US disclosed
US-20140178325-A1 Anti-Settling and Thickening Compositions and Methods for Using Same RHODIA OPERATIONS (FR) 2014-06-26 US disclosed
EP-2534205-A2 RHEOLOGY MODIFIER COMPOSITIONS AND METHODS OF USE Rhodia Operations (FR) 2012-12-19 EP disclosed
EP-2534184-A1 RHEOLOGY MODIFIER POLYMER Rhodia Operations (FR) 2012-12-19 EP disclosed
US-20110256085-A1 RHEOLOGY MODIFIER COMPOSITIONS AND METHODS OF USE RHODIA OPERATIONS (FR) 2011-10-20 US disclosed
US-20110243873-A1 Rheology modifier polymer RHODIA OPERATIONS (FR) 2011-10-06 US disclosed
US-20110223125-A1 COMPOSITIONS WITH FREEZE THAW STABILITY RHODIA OPERATIONS (FR) 2011-09-15 US disclosed
WO-2011100665-A2 RHEOLOGY MODIFIER COMPOSITIONS AND METHODS OF USE RHODIA OPERATIONS (FR) 2011-08-18 WO disclosed
WO-2011100071-A1 RHEOLOGY MODIFIER POLYMER RHODIA OPERATIONS (FR) 2011-08-18 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 (5 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-20110223125-A1 COMPOSITIONS WITH FREEZE THAW STABILITY C9, PUF60, BCL2L10 MAPT 73/4885TLR8 764/4885FUT7 370/4885
US-20140178324-A1 Compositions with pH Responsive Copolymer Containing MAEP and/or MAHP and Method for Using Same PRUNE1, PHLPP1, PHLPP2 MAPT 328/4885TLR8 2925/4885FUT7 1925/4885
US-20140178325-A1 Anti-Settling and Thickening Compositions and Methods for Using Same GRN, CAPG, C5 MAPT 1339/4885TLR8 4047/4885FUT7 596/4885
US-20110256085-A1 RHEOLOGY MODIFIER COMPOSITIONS AND METHODS OF USE SFN, YWHAZ, DSG1 MAPT 2593/4885TLR8 2805/4885FUT7 1896/4885
US-20110243873-A1 Rheology modifier polymer C1R, PUF60, C9 MAPT 424/4885TLR8 1203/4885FUT7 1325/4885

“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.