Heptanoate

Heptanoate

SCHEMBL588180

CCCCCCC(=O)[O-].CCCCCCC(=O)[O-].[Ca+2]

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Heptanoate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FABP3 P05413 7/20 0.72
▸ CA1 P00915 1/20 0.71
▸ CES2 O00748 4/20 0.67
▸ CES1 P23141 4/20 0.67
▸ FFAR3 O14843 1/20 0.57
▸ HDAC3 O15379 1/20 0.57
▸ HDAC1 Q13547 1/20 0.57
▸ HDAC2 Q92769 1/20 0.57
▸ HDAC8 Q9BY41 1/20 0.57
▸ NFKB1 P19838 1/20 0.57

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
SCHEMBL8743307 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Stearic Acid SCHEMBL13836877 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Palmitic Acid SCHEMBL141829 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Myristic Acid SCHEMBL360184 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Undecanoate SCHEMBL11343015 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Decanoic Acid SCHEMBL453322 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Stearic Acid SCHEMBL2371 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Arachidic Acid SCHEMBL7629156 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Stearic Acid SCHEMBL9243538 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3
Lignoceric Acid SCHEMBL262204 1.00 FABP3 (0.72) FABP3CA1CES2CES1FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025060941-A1 METHOD FOR PRODUCING POLYHYDROXYALKANOATE 清华大学 2025-03-27 — — WO claimed
CN-116970659-B Method for producing polyhydroxyalkanoate 清华大学 2024-02-09 — — CN claimed
US-20180161365-A1 Phosphate-Binding Magnesium Salts And Uses Thereof CURRAX PHARMACEUTICALS LLC 2018-06-14 — — US claimed
US-9889157-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2018-02-13 — — US claimed
US-20170202875-A1 Phosphate-Binding Magnesium Salts And Uses Thereof WILMINGTON SAVINGS FUND SOCIETY, FSB 2017-07-20 — — US claimed
US-9610267-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2017-04-04 — — US claimed
US-20160256420-A1 Phosphate-Binding Magnesium Salts And Uses Thereof WILMINGTON SAVINGS FUND SOCIETY, FSB 2016-09-08 — — US claimed
US-9339481-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2016-05-17 — — US claimed
US-20130004542-A1 COMPOSITION INNOVATA LIMITED (GB) 2013-01-03 — — US claimed
EP-2490670-A2 COMPOSITION FOR INHALATION Innovata Limited (GB) 2012-08-29 — — EP claimed
EP-2416786-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF Cypress Pharmaceutical, Inc. (US) 2012-02-15 — — EP claimed
WO-2011048379-A2 COMPOSITION INNOVATA LIMITED (GB) 2011-04-28 — — WO claimed
WO-2010117370-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF CYPRESS PHARMACEUTICALS, INC. (US) 2010-10-14 — — WO claimed
US-20090269399-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF CYPRESS PHARMACEUTICAL, INC. (US) 2009-10-29 — — US claimed
US-20250353078-A1 COMPOUND, MOLDED BODY AND CURED PRODUCT RESONAC CORP (JP) 2025-11-20 — — US disclosed
WO-2025060941-A1 METHOD FOR PRODUCING POLYHYDROXYALKANOATE 清华大学 2025-03-27 — — WO disclosed
EP-4525004-A1 COMPOUND, MOLDED BODY AND CURED PRODUCT Resonac Corporation (JP) 2025-03-19 — — EP disclosed
EP-0458509-A1 Oxidation-resistant ethylene vinyl alcohol polymer compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-11-27 — — EP disclosed
US-5032632-A Oxidation-resistant ethylene vinyl alcohol polymer compositions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-07-16 — — US disclosed
US-4058540-A FROM A NITROALKYL NITRATE OR NITRO ALCOHOL AND ALKANOIC ACID, CALCIUM OCIDE OR CARBOXYLATE CATALYST TEXACO INC. (US) 1977-11-15 — — 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 (1 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-20130004542-A1 COMPOSITION MATR3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, IL5 FABP3 4194/4885CA1 385/4885CES2 4722/4885

“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.

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