Adipic Acid

Adipic Acid

SCHEMBL8076334

C[Sn]C.O=C(O)CCCCC(=O)O

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC18A2SLC6A2SLC6A3

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

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.73
TSHR P16473 5/20 0.69
NFKB1 P19838 1/20 0.69
PMP22 Q01453 1/20 0.69
AKR1B1 P15121 1/20 0.63
SLC22A6 Q4U2R8 2/20 0.62
GPR84 Q9NQS5 8/20 0.60
PPARG P37231 7/20 0.60
PPARD Q03181 7/20 0.60
PPARA Q07869 7/20 0.60
HDAC11 Q96DB2 5/20 0.60
PTPN1 P18031 3/20 0.60
ALDH1A1 P00352 2/20 0.60
TLR2 O60603 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
FABP4 P15090 2/20 0.60
FFAR1 O14842 2/20 0.60
FFAR4 Q5NUL3 2/20 0.60
SLC22A8 Q8TCC7 1/20 0.60
MEN1 O00255 1/20 0.60

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
Sebacic Acid SCHEMBL28121390 0.97 TSHR (0.75) LMNATSHRNFKB1PMP22AKR1B1
Decanoic Acid SCHEMBL22471653 0.87 GPR84 (0.85) LMNATSHRAKR1B1SLC22A6GPR84
Behenic Acid SCHEMBL28995864 0.87 GPR84 (0.85) LMNATSHRAKR1B1SLC22A6GPR84
Stearic Acid SCHEMBL28384522 0.87 GPR84 (0.85) LMNATSHRAKR1B1SLC22A6GPR84
Succinic Acid SCHEMBL209622 0.86 EGLN1 (0.69) LMNATSHRNFKB1PMP22AKR1B1
Adipic Acid SCHEMBL11767551 0.86 LMNA (0.85) LMNATSHRNFKB1PMP22AKR1B1
Adipic Acid SCHEMBL10388302 0.86 LMNA (0.85) LMNATSHRNFKB1PMP22AKR1B1
Adipic Acid SCHEMBL8941691 0.86 LMNA (1.00) LMNATSHRNFKB1PMP22AKR1B1
Adipic Acid SCHEMBL2244299 0.86 LMNA (1.00) LMNATSHRNFKB1PMP22AKR1B1
Adipic Acid SCHEMBL1330953 0.86 LMNA (1.00) LMNATSHRNFKB1PMP22AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765891-B1 Process for the preparation of water-blown integral skin polyurethane foams and catalysts useful therein BAYER AG (US) 2000-08-09 EP disclosed
EP-0765891-A1 Water-blown integral skin polyurethane foams and catalysts useful therein Bayer Corporation (US) 1997-04-02 EP disclosed
US-5514723-A POLYMERIZATION USING CATALYST MIXTURE OF DIORGANOTIN SULFIDE, TERTIARY AMINE, AND TIN COMPOUND BAYER CORPORATION (US) 1996-05-07 US disclosed
US-4855352-A Process for the production of stable dispersions, the dispersions so produced, and the use thereof in the manufacture of polyurethanes MOBAY CORPORATION (US) 1989-08-08 US disclosed
US-4353995-A TERTIARY AMINE, TIN COMPOUND, AND BARIUM OR CALCIUM CARBOXYLATE MOBAY CHEMICAL CORPORATION (US) 1982-10-12 US disclosed
EP-0016355-A2 Novel catalyst system for polyurethane foams and the use thereof Mobay Chemical Corporation (US) 1980-10-01 EP disclosed
US-4217247-A TERTIARY AMINE, TIN COMPOUND, CALCIUM OR BARIUM CARBOXYLATE MOBAY CHEMICAL CORPORATION (US) 1980-08-12 US disclosed