SCHEMBL17102790

SCHEMBL17102790

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

nearest known ligand 0.41

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
CA4 known ✓ P22748 2/20 0.41
CA2 known ✓ P00918 3/20 0.38
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
NFKB1 P19838 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
CTSL P07711 1/20 0.35
MEN1 O00255 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30

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
Tricarballylic Acid SCHEMBL4898296 0.82 CA4 (0.57) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL29165746 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL30504723 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL11318639 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL8979864 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL6757050 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL8329650 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL11318645 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL28977121 0.77 CA4 (0.52) CA4CA2CYP3A4TSHRNFKB1
Tricarballylic Acid SCHEMBL6551788 0.73 CA4 (0.48) CA4CA2CYP3A4TSHRNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037542-B2 Method of using multicarboxylate compositions in enhanced oil recovery CHEVRON U.S.A. INC. 2024-07-16 US disclosed
US-20220162499-A1 METHOD OF USING MULTICARBOXYLATE COMPOSITIONS IN ENHANCED OIL RECOVERY CHEVRON U.S.A. INC. 2022-05-26 US disclosed
US-11248159-B2 Method of using multicarboxylate compositions in enhanced oil recovery CHEVRON U.S.A. INC. (US) 2022-02-15 US disclosed
US-20190153299-A1 METHOD OF USING MULTICARBOXYLATE COMPOSITIONS IN ENHANCED OIL RECOVERY CHEVRON U.S.A. INC. 2019-05-23 US disclosed
US-10233382-B2 Method of using multicarboxylate compositions in enhanced oil recovery CHEVRON U.S.A. INC. (US) 2019-03-19 US disclosed
US-9976072-B2 Multicarboxylate compositions and method of making the same CHEVRON U.S.A. INC. (US) 2018-05-22 US disclosed
EP-2924093-B1 MULTICARBOXYLATE COMPOSITIONS AND METHOD OF MAKING THE SAME CHEVRON USA INC (US) 2017-11-29 EP disclosed
US-20170198202-A1 METHOD OF USING MULTICARBOXYLATE COMPOSITIONS IN ENHANCED OIL RECOVERY CHEVRON U.S.A. INC. 2017-07-13 US disclosed
US-20150275068-A1 Multicarboxylate Compositions And Method Of Making The Same CHEVRON U.S.A. INC. 2015-10-01 US disclosed
EP-2924093-A1 MULTICARBOXYLATE COMPOSITIONS AND METHOD OF MAKING THE SAME Chevron U.S.A., Inc. (US) 2015-09-30 EP 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 (6 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-11248159-B2 Method of using multicarboxylate compositions in enhanced oil recovery SCO2, ELOVL3, PCCA CA4 2218/4885CA2 561/4885CYP3A4 2062/4885
US-10233382-B2 Method of using multicarboxylate compositions in enhanced oil recovery SCO2, PCCA, SLC25A20 CA4 1142/4885CA2 146/4885CYP3A4 2068/4885
US-20150275068-A1 Multicarboxylate Compositions And Method Of Making The Same ALKBH3, C9, SLC25A20 CA4 926/4885CA2 59/4885CYP3A4 2138/4885
US-20220162499-A1 METHOD OF USING MULTICARBOXYLATE COMPOSITIONS IN ENHANCED OIL RECOVERY SCO2, ELOVL3, PCCA CA4 2040/4885CA2 463/4885CYP3A4 2005/4885
US-12037542-B2 Method of using multicarboxylate compositions in enhanced oil recovery SCO2, ELOVL3, PCCA CA4 2040/4885CA2 463/4885CYP3A4 2005/4885
US-20190153299-A1 METHOD OF USING MULTICARBOXYLATE COMPOSITIONS IN ENHANCED OIL RECOVERY SCO2, ELOVL3, PCCA CA4 2218/4885CA2 561/4885CYP3A4 2062/4885

“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.