SCHEMBL401361

SCHEMBL401361

CCCCCCCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.46

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 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
RECQL P46063 2/20 0.45
GLA P06280 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
EPHX2 P34913 1/20 0.45
BLM P54132 1/20 0.45
NAAA Q02083 1/20 0.42
EPHX1 P07099 1/20 0.40
CES2 O00748 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37

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
SCHEMBL2729134 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL158736 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL208566 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL5982864 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL4941637 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL11203648 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
SCHEMBL4809983 1.00 TSHR (0.45) TSHRRECQLGLAHPGDMAPK1
Potassium Ion SCHEMBL8777175 0.97 NAAA (0.42) TSHRRECQLGLAHPGDMAPK1
SCHEMBL2120646 0.92 FABP3 (0.47) EPHX2
SCHEMBL11128465 0.91 RECQL (0.45) TSHRRECQLGLAHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014128564-A2 PHARMACEUTICAL COMPOSITIONS OF CETP INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2014-08-28 WO claimed
EP-1938800-A1 Sirolimus nanodispersion Ranbaxy Laboratories Limited (IN) 2008-07-02 EP claimed
US-20080138405-A1 SIROLIMUS NANODISPERSION RANBAXY LABORATORIES LIMITED (IN) 2008-06-12 US claimed
EP-1556001-A2 THERAPEUTIC COMPOSITIONS FOR DRUG DELIVERY TO AND THROUGH COVERING EPITHELIA UMD, Inc. (US) 2005-07-27 EP claimed
EP-1545473-A2 MODIFIED RELEASE, MULTIPLE UNIT DRUG DELIVERY SYSTEMS RANBAXY LABORATORIES, LTD. (IN) 2005-06-29 EP claimed
US-20040151774-A1 Therapeutic compositions for drug delivery to and through covering epithelia UMD, INC. 2004-08-05 US claimed
WO-2004056336-A2 CONTROLLED RELEASE, MULTIPLE UNIT DRUG DELIVERY SYSTEMS RANBAXY LABORATORIES LIMITED (IN) 2004-07-08 WO claimed
WO-2004041118-A2 THERAPEUTIC COMPOSITIONS FOR DRUG DELIVERY TO AND THROUGH COVERING EPITHELIA UMD, INC. (US) 2004-05-21 WO claimed
WO-2003103637-A2 MODIFIED RELEASE, MULTIPLE UNIT DRUG DELIVERY SYSTEMS RANBAXY LABORATORIES LIMITED (IN) 2003-12-18 WO claimed
US-12629369-B2 Pharmaceutical compositions of nilotinib AZURITY PHARMACEUTICALS, INC. (US) 2026-05-19 US disclosed
EP-3824296-B1 ORAL PHARMACEUTICAL COMPOSITION COMPRISING TESTOSTERONE TRIDECANOATE AND/OR TESTOSTERONE DODECANOATE FOR TREATING LIVER DISEASES LIPOCINE INC (US) 2026-04-01 EP disclosed
US-20250352482-A1 AMORPHOUS DOSAGE FORM CONTAINING EBSELEN SOUND PHARMACEUTICALS INC (US) 2025-11-20 US disclosed
US-20250332165-A1 PHARMACEUTICAL COMPOSITIONS OF NILOTINIB AZURITY PHARMACEUTICALS, INC. (US) 2025-10-30 US disclosed
US-20250302819-A1 PHARMACEUTICAL COMPOSITIONS OF CABOZANTINIB AZURITY PHARMACEUTICALS, INC. (US) 2025-10-02 US disclosed
WO-2001001960-A1 CLEAR OIL-CONTAINING PHARMACEUTICAL COMPOSITIONS LIPOCINE, INC. (US) 2001-01-11 WO disclosed
WO-2000059475-A1 COMPOSITIONS AND METHODS FOR IMPROVED DELIVERY OF IONIZABLE HYDROPHOBIC THERAPEUTIC AGENTS LIPOCINE, INC. (US) 2000-10-12 WO disclosed
WO-2000050007-A1 COMPOSITIONS AND METHODS FOR IMPROVED DELIVERY OF HYDROPHOBIC THERAPEUTIC AGENTS LIPOCINE, INC. (US) 2000-08-31 WO disclosed
EP-0436240-B2 Process for preparing a high bulk density detergent composition having improved dispensing properties UNILEVER NV (NL) 2000-06-14 EP disclosed
US-4820448-A DETERGENTS, GOOD FLOW, POURABLE, PUMPABLE AT ROOM TEMPERATURE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-04-11 US disclosed
US-4649169-A Crosslinked vinyl polymer compositions and process for preparing molded shaped articles HENKEL CORPORATION (US) 1987-03-10 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 (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-12629369-B2 Pharmaceutical compositions of nilotinib CSNK1D, PPARD, TP53 TSHR 2930/4885RECQL 2062/4885GLA 1087/4885
US-20250302819-A1 PHARMACEUTICAL COMPOSITIONS OF CABOZANTINIB ABL1, KRAS, PIK3CA TSHR 3596/4885RECQL 2803/4885GLA 3390/4885
US-20250352482-A1 AMORPHOUS DOSAGE FORM CONTAINING EBSELEN SBDS, RPS27L, CYP2C9 TSHR 3659/4885RECQL 1310/4885GLA 4230/4885

“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.