SCHEMBL6053545

SCHEMBL6053545

O=C([O-])CCCCCCCCCCC(=O)[O-].[Na+].[Na+]

nearest known ligand 0.65

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 15)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 2/20 0.63
CA4 known ✓ P22748 1/20 0.47
HDAC3 O15379 3/20 0.53
HDAC1 Q13547 3/20 0.53
HDAC2 Q92769 3/20 0.53
HDAC8 Q9BY41 3/20 0.53
FFAR3 O14843 2/20 0.53
FABP3 P05413 7/20 0.52
HDAC4 P56524 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 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
SCHEMBL28402678 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
SCHEMBL30930281 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
Pimelic Acid SCHEMBL6756717 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
Sebacic Acid SCHEMBL306520 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
SCHEMBL20577558 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
Azelaic Acid SCHEMBL852024 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
SCHEMBL11046980 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
Octanedioate SCHEMBL188028 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
SCHEMBL8325989 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8
Sebacic Acid SCHEMBL29696252 1.00 CA1 (0.63) CA1HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112175708-B Aluminum alloy cutting fluid and preparation method thereof 山东龙程矿业科技股份有限公司 2022-05-03 CN claimed
WO-2021238311-A1 WATER-BASED ALUMINUM WIRE DRAWING LIQUID AND USE METHOD THEREOF 安美科技股份有限公司 2021-12-02 WO claimed
WO-2021238309-A1 NEW PROCESS FOR ALUMINUM WIRE DRAWING 安美科技股份有限公司 2021-12-02 WO claimed
CN-109482184-B Preparation method of catalyst for synthesizing ethylene glycol by dimethyl oxalate hydrogenation 中触媒新材料股份有限公司 2021-09-17 CN claimed
CN-109482185-B High-dispersion stable copper-based catalyst and preparation method thereof 中触媒新材料股份有限公司 2021-06-29 CN claimed
CN-112175708-A Aluminum alloy cutting fluid and preparation method thereof 山东龙程矿业科技股份有限公司 2021-01-05 CN claimed
CN-111822531-A Novel aluminum wire drawing process 安美科技股份有限公司 2020-10-27 CN claimed
CN-111808659-A Water-based aluminum wire drawing liquid and use method thereof 安美科技股份有限公司 2020-10-23 CN claimed
CN-106336859-B A kind of composition and its application and oil base drilling fluid and the method for improving oil base drilling fluid shear force 中国石油化工股份有限公司 2019-05-24 CN claimed
CN-109482184-A A kind of hydrogenation of dimethyl oxalate to synthesizing ethylene glycol method for preparing catalyst 中触媒新材料股份有限公司 2019-03-19 CN claimed
CN-109482185-A A kind of high dispersive stable type copper-based catalysts and preparation method thereof 中触媒新材料股份有限公司 2019-03-19 CN claimed
US-10150903-B2 Composition and use therof, oil-based drilling fluid and a method for raising shearing force of oil-based drilling fluid CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2018-12-11 US claimed
CN-106336859-A Composition, application and oil-based drilling fluid thereof, method for improving shearing force of oil-based drilling fluid 中国石油化工股份有限公司 2017-01-18 CN claimed
US-20170009121-A1 COMPOSITION AND USE THEREOF, OIL-BASED DRILLING FLUID AND A METHOD FOR RAISING SHEARING FORCE OF OIL-BASED DRILLING FLUID CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2017-01-12 US claimed
EP-4159772-B1 CPVC PIPE HAVING IMPROVED RESISTANCE TO ENVIRONMENTAL STRESS CRACKING LUBRIZOL ADVANCED MAT INC (US) 2026-03-25 EP disclosed
US-12559611-B2 Hydrophobic alginic acid particle group and method for producing same NISSHINBO HOLDINGS INC. (JP) 2026-02-24 US disclosed
US-20250388501-A1 COMPOSITION AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2025-12-25 US disclosed
US-4960861-A REACTING POLYHALOAROMATIC WITH SULFIDIZING AGENT; SOLVENTS AND ADDITIVE TO SEPARATE HIGH AND LOW MOLECULA WEIGHT POLYMERS DAINIPPON INK AND CHEMICALS, INC. (JP) 1990-10-02 US disclosed
EP-0268765-A2 Resin comprising a polyphenylene sulfide/polyphenylene sulfone block copolymer, process for preparing the copolymer and molded article DAINIPPON INK AND CHEMICALS, INC. (JP) 1988-06-01 EP disclosed
US-4588513-A Non-borate, non-phosphate antifreeze formulations containing dibasic acid salts as corrosion inhibitors TEXACO, INC. (US) 1986-05-13 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 (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-20250388501-A1 COMPOSITION AND USE THEREOF GSS, GPX4, SPAST CA1 139/4885CA4 456/4885HDAC3 1149/4885
US-12559611-B2 Hydrophobic alginic acid particle group and method for producing same ALG3, ALG1, HACD3 CA1 621/4885CA4 629/4885HDAC3 2644/4885

“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.