Heptanoate

Heptanoate

SCHEMBL105464

CCCCCCC(=O)[O-].[Na+]

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 11)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 1/20 0.80
FABP3 P05413 7/20 0.72
CES2 O00748 4/20 0.67
CES1 P23141 4/20 0.67
NFKB1 P19838 1/20 0.63
FFAR3 O14843 1/20 0.62
HDAC3 O15379 1/20 0.62
HDAC1 Q13547 1/20 0.62
HDAC2 Q92769 1/20 0.62
HDAC8 Q9BY41 1/20 0.62
GPR84 Q9NQS5 1/20 0.61

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
Nonanoate SCHEMBL107546 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Tridecanoate SCHEMBL1852615 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Hexacosanoic Acid SCHEMBL6568273 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Octanoic Acid SCHEMBL1332721 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Stearic Acid SCHEMBL583901 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Palmitic Acid SCHEMBL1958881 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Lignoceric Acid SCHEMBL4889106 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Decanoic Acid SCHEMBL5982539 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Octanoic Acid SCHEMBL56211 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1
Palmitic Acid SCHEMBL1332725 1.00 CA1 (0.80) CA1FABP3CES2CES1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3861986-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING POLYPEPTIDES AND RELATED METHODS OF DELIVERY AMRYT ENDO INC (US) 2025-11-26 EP claimed
US-20250345438-A1 PHARMACEUTICAL COMPOSITIONS AND RELATED METHODS OF DELIVERY AMRYT ENDO INC (US) 2025-11-13 US claimed
EP-4127119-B1 WATER-GLYCOL HYDRAULIC FLUID SHELL INT RESEARCH (NL) 2025-08-27 EP claimed
EP-3253401-B1 TREATING ACROMEGALY WITH ORAL OCTREOTIDE AMRYT ENDO INC (US) 2025-04-02 EP claimed
WO-2025060941-A1 METHOD FOR PRODUCING POLYHYDROXYALKANOATE 清华大学 2025-03-27 WO claimed
EP-4527456-A2 TREATING ACROMEGALY WITH ORAL OCTREOTIDE Amryt Endo, Inc. (US) 2025-03-26 EP claimed
CN-119280450-A Medical fabric dressing with long-acting disinfection and sterilization functions and preparation method thereof 孙国明 2025-01-10 CN claimed
CN-118844448-A Preparation method of long-acting antibacterial liquid 孙国明 2024-10-29 CN claimed
CN-118844836-A Long-acting disinfection and sterilization wet (towel) paper 孙国明 2024-10-29 CN claimed
CN-118652422-A High-purity high-temperature-resistant anti-aging low-dielectric polyphenyl ether and preparation method thereof 四川大学 2024-09-17 CN claimed
US-6689289-B1 COMPOSITION COMPRISING MIXTURE OF C1-C2 CARBOXYLIC ACID SALT, C3-C5 CARBOXYLIC ACID SALT AND C6-C12 CARBOXYLATE TEXACO INC. 2004-02-10 US claimed
EP-1206504-A1 SYNERGISTIC COMBINATIONS OF CARBOXYLATES FOR USE AS FREEZING POINT DEPRESSANTS AND CORROSION INHIBITORS IN HEAT TRANSFER FLUIDS TEXACO DEVELOPMENT CORPORATION (US) 2002-05-22 EP claimed
EP-1087004-A1 Synergistic combinations of carboxylates for use as freezing point depressants and corrosion inhibitors in heat transfer fluids TEXACO DEVELOPMENT CORPORATION (US) 2001-03-28 EP claimed
WO-2001005906-A1 SYNERGISTIC COMBINATIONS OF CARBOXYLATES FOR USE AS FREEZING POINT DEPRESSANTS AND CORROSION INHIBITORS IN HEAT TRANSFER FLUIDS TEXACO DEVELOPMENT CORPORATION (US) 2001-01-25 WO claimed
US-6110251-A WITH POLYMER, NUCLEATING AGENT AND ELECTROSTATIC CHARGING ENHANCER JOHNS MANVILLE INTERNATIONAL, INC. (US) 2000-08-29 US claimed
EP-0754779-B1 Process for treating steel sheet surfaces which are partially coated by zinc or a zinc alloy LORRAINE LAMINAGE (FR) 1998-09-09 EP claimed
US-5683751-A Process for surface treatment of sheet steel partially coated with zinc or zinc alloy SOLLAC (FR) 1997-11-04 US claimed
EP-0113593-B1 LONG SHELF LIFE CEMENTITIOUS ANCHORING CAPSULE FOSROC INTERNATIONAL LIMITED (GB) 1988-04-13 EP claimed
US-4534795-A CATALYST, COMPLEXING AGENT; SELF-SETTING FOSROC INTERNATIONAL LIMITED (GB) 1985-08-13 US claimed
EP-0113593-A2 Long shelf life cementitious anchoring capsule FOSROC INTERNATIONAL LIMITED (GB) 1984-07-18 EP claimed