Adipic Acid

Adipic Acid

SCHEMBL6408549

COC(=O)CCCCC(=O)OC.O=C(O)CCCCC(=O)O

nearest known ligand 0.90

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
TSHR P16473 8/20 0.90
LMNA P02545 3/20 0.58
ALDH1A1 P00352 4/20 0.56
NFKB1 P19838 1/20 0.55
PMP22 Q01453 1/20 0.55
AKR1B1 P15121 1/20 0.52
PPARG P37231 6/20 0.50
PPARD Q03181 6/20 0.50
PPARA Q07869 6/20 0.50
HDAC11 Q96DB2 5/20 0.50
GPR84 Q9NQS5 4/20 0.50
SLC22A6 Q4U2R8 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
PTPN1 P18031 2/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL194401 1.00 TSHR (0.90) TSHRLMNAALDH1A1NFKB1PMP22
Sebacic Acid SCHEMBL10956921 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
SCHEMBL3502474 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
Adipic Acid SCHEMBL3799583 0.97 TSHR (0.95) TSHRLMNAALDH1A1NFKB1PMP22
SCHEMBL905415 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
Adipic Acid SCHEMBL10792220 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
SCHEMBL3504014 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
SCHEMBL3504444 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
SCHEMBL3503428 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22
Sebacic Acid SCHEMBL10962129 0.97 TSHR (0.86) TSHRLMNAALDH1A1NFKB1PMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263797-A Reactive distillation and purification method for preparing dimethyl adipate 唐山中溶科技有限公司 2023-12-22 CN disclosed
CN-1802330-A Cement dispersant and concrete composition containing the dispersant SIKA LTD (JP) 2006-07-12 CN disclosed
CN-1777565-A Cement dispersing agent and concrete composition comprising same NIPPON SEQUA K K (JP) 2006-05-24 CN disclosed
WO-2005037426-A1 CONICAL GAS / LIQUID SEPARATOR WITH A STIRRER FOR MAKING A GREASE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2005-04-28 WO disclosed
CN-1225919-A Synthesizing method for dimethyl ester of mixed acid of butane diacid, glutaric acid and hexane diacid YUEYANG PETRO CHEMICAL GENERAL (CN) 1999-08-18 CN disclosed