Adipic Acid

Adipic Acid

SCHEMBL1506376

Cc1cccc(C)c1.N.O=C(O)CCCCC(=O)O

nearest known ligand 0.64

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
SLC6A3 known ✓ Q01959 1/20 0.45
TSHR P16473 2/20 0.51
ACHE P22303 1/20 0.50
FFAR1 O14842 2/20 0.49
HDAC3 O15379 4/20 0.47
HDAC1 Q13547 4/20 0.47
HDAC2 Q92769 4/20 0.47
HDAC10 Q969S8 4/20 0.47
HDAC11 Q96DB2 4/20 0.47
HDAC8 Q9BY41 4/20 0.47
HDAC6 Q9UBN7 4/20 0.47
HDAC4 P56524 3/20 0.47
HDAC7 Q8WUI4 3/20 0.47
HDAC9 Q9UKV0 3/20 0.47
HDAC5 Q9UQL6 3/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KMT2A Q03164 3/20 0.46
NCOR2 Q9Y618 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
Adipic Acid SCHEMBL5180701 1.00 TSHR (0.51) TSHRACHEFFAR1HDAC3HDAC1
Adipic Acid SCHEMBL15167368 0.98 TSHR (0.53) TSHRACHEFFAR1HDAC3HDAC1
Sebacic Acid SCHEMBL9311898 0.96 HDAC11 (0.52) TSHRACHEFFAR1HDAC3HDAC1
Hexanoate SCHEMBL29016066 0.90 AKR1B1 (0.59) TSHRFFAR1HDAC11MAPTKMT2A
Adipic Acid SCHEMBL28584893 0.90 TSHR (0.51) TSHRACHEFFAR1HDAC3HDAC1
Dodecanoate SCHEMBL28418541 0.89 GPR84 (0.61) TSHRFFAR1HDAC11MAPTKMT2A
Sebacic Acid SCHEMBL28395117 0.89 HDAC3 (0.50) TSHRACHEFFAR1HDAC3HDAC1
Azelaic Acid SCHEMBL28393484 0.89 HDAC3 (0.50) TSHRACHEFFAR1HDAC3HDAC1
M-Xylene SCHEMBL3694363 0.89 PARP1 (0.47) TSHRACHEFFAR1HDAC3HDAC1
Glutarate SCHEMBL28401701 0.86 TSHR (0.51) TSHRACHEFFAR1HDAC3HDAC1

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-113613901-A Multilayer structure and package 三菱化学株式会社 2021-11-05 CN disclosed
EP-2301998-B1 PROCESS FOR PRODUCING EVOH COMPOSITE MATERIAL NIPPON SYNTHETIC CHEM IND (JP) 2014-11-26 EP disclosed
US-8722785-B2 Process for producing EVOH composite THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) 2014-05-13 US disclosed
US-20110178222-A1 PROCESS FOR PRODUCING EVOH COMPOSITE THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD., (JP) 2011-07-21 US disclosed
EP-2301998-A1 PROCESS FOR PRODUCING EVOH COMPOSITE MATERIAL The Nippon Synthetic Chemical Industry Co., Ltd. (JP) 2011-03-30 EP disclosed