Adipic Acid

Adipic Acid

SCHEMBL2964088

CCOCCOCCO.O=C(O)CCCCC(=O)O.OCCOCCO

nearest known ligand 0.56

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
ALDH1A1 P00352 4/20 0.56
GPR84 Q9NQS5 8/20 0.46
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 2/20 0.46
AKR1B1 P15121 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
THRB P10828 1/20 0.45
HTT P42858 1/20 0.45
MAPT P10636 1/20 0.45
PPARG P37231 6/20 0.45
PPARD Q03181 6/20 0.45
PPARA Q07869 6/20 0.45
TSHR P16473 5/20 0.45
HDAC11 Q96DB2 5/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45
PTPN1 P18031 2/20 0.45
SLC22A6 Q4U2R8 1/20 0.45

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
Adipic Acid SCHEMBL2954452 1.00 ALDH1A1 (0.56) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Adipic Acid SCHEMBL2962337 0.94 ALDH1A1 (0.52) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Stearic Acid SCHEMBL9615288 0.93 GPR84 (0.59) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Stearic Acid SCHEMBL28198343 0.93 GPR84 (0.59) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Diethylene Glycol Monoethyl Ether SCHEMBL2961558 0.92 ALDH1A1 (0.61) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Triethylene Glycol SCHEMBL2959242 0.92 ALDH1A1 (0.61) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Adipic Acid SCHEMBL4797011 0.92 AKR1B1 (0.54) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Hexanoate SCHEMBL28173172 0.90 AKR1B1 (0.61) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Diethylene Glycol Monoethyl Ether SCHEMBL2782102 0.90 EPHX2 (0.49) ALDH1A1GPR84FFAR1FFAR4AKR1B1
Adipic Acid SCHEMBL28167133 0.90 GPR84 (0.52) ALDH1A1GPR84FFAR1FFAR4AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7766978-B2 Acidic hair dyeing method KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2010-08-03 US disclosed
US-20090100609-A1 ACIDIC HAIR DYE COMPOSITION KOKYU ALCOHOL KOGYO CO., LTD. (JP) 2009-04-23 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-20090100609-A1 ACIDIC HAIR DYE COMPOSITION H1-0, MRM1, H1-4 ALDH1A1 81/4885GPR84 845/4885FFAR1 747/4885

“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.