Adipic Acid

Adipic Acid

SCHEMBL4586144

CN(CCO)CCO.O=C(O)CCCCC(=O)O

nearest known ligand 0.54

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
GPR84 Q9NQS5 8/20 0.54
FFAR1 O14842 2/20 0.54
FFAR4 Q5NUL3 2/20 0.54
LMNA P02545 2/20 0.52
CAMK2A Q9UQM7 1/20 0.52
TSHR P16473 5/20 0.50
NFKB1 P19838 1/20 0.50
PMP22 Q01453 1/20 0.50
AKR1B1 P15121 1/20 0.48
PPARG P37231 6/20 0.46
PPARD Q03181 6/20 0.46
PPARA Q07869 6/20 0.46
HDAC11 Q96DB2 5/20 0.46
ALDH1A1 P00352 2/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
PTPN1 P18031 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 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
SCHEMBL26495422 0.96 KDM4C (0.51) GPR84FFAR1FFAR4LMNACAMK2A
SCHEMBL26495489 0.94 GPR84 (0.54) GPR84FFAR1FFAR4LMNATSHR
SCHEMBL12051225 0.94 GPR84 (0.54) GPR84FFAR1FFAR4LMNATSHR
SCHEMBL26495622 0.94 GPR84 (0.54) GPR84FFAR1FFAR4LMNATSHR
SCHEMBL26495389 0.93 KDM4C (0.50) GPR84FFAR1FFAR4LMNACAMK2A
Stearic Acid SCHEMBL28730472 0.90 GPR84 (0.65) GPR84FFAR1FFAR4TSHRAKR1B1
Stearic Acid SCHEMBL27886665 0.90 GPR84 (0.65) GPR84FFAR1FFAR4TSHRAKR1B1
SCHEMBL3952397 0.88 KMT2A (0.48) CAMK2AMEN1KMT2A
SCHEMBL26495428 0.86 GPR84 (0.56) GPR84FFAR1FFAR4LMNACAMK2A
SCHEMBL26495437 0.86 GPR84 (0.62) GPR84FFAR1FFAR4LMNACAMK2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1469813-A4 ADDITIVES AND PRODUCTS INCLUDING OLIGOESTERS CRODA INC (US) 2008-08-27 EP disclosed
EP-1469813-A2 ADDITIVES AND PRODUCTS INCLUDING OLIGOESTERS Croda, Inc. (US) 2004-10-27 EP disclosed
WO-2003063790-A2 ADDITIVES AND PRODUCTS INCLUDING OLIGOESTERS CRODA, INC. (US) 2003-08-07 WO disclosed
US-3975350-A HYDROPHILIC OR HYDROGEL CARRIER SYSTEMS SUCH AS COATINGS, BODY IMPLANTS AND TOHER ARTICLES PRINCETON POLYMER LABORATORIES, INCORPORATED (US) 1976-08-17 US disclosed