Adipic Acid

Adipic Acid

SCHEMBL28059378

O=C(O)CCCCC(=O)O.c1ccc2ccccc2c1

nearest known ligand 0.62

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 0.60
CYP1A2 P05177 2/20 0.62
HDAC3 O15379 2/20 0.61
HDAC4 P56524 2/20 0.61
HDAC1 Q13547 2/20 0.61
HDAC7 Q8WUI4 2/20 0.61
HDAC2 Q92769 2/20 0.61
HDAC10 Q969S8 2/20 0.61
HDAC11 Q96DB2 2/20 0.61
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
HDAC9 Q9UKV0 2/20 0.61
HDAC5 Q9UQL6 2/20 0.61
MAPT P10636 2/20 0.61
RXFP1 Q9HBX9 1/20 0.61
MAPK1 P28482 1/20 0.60
ADRA1A P35348 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
LMNA P02545 3/20 0.58
TSHR P16473 1/20 0.55

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 SCHEMBL28144623 0.97 CYP1A2 (0.60) CYP1A2HDAC3HDAC4HDAC1HDAC7
Naphthalene SCHEMBL16044499 0.89 NR4A2 (0.61) CYP1A2HDAC3HDAC4HDAC1HDAC7
Naphthalene SCHEMBL30124954 0.89 NR4A2 (0.61) CYP1A2HDAC3HDAC4HDAC1HDAC7
Sebacic Acid SCHEMBL28907869 0.89 HDAC11 (0.57) CYP1A2HDAC3HDAC4HDAC1HDAC7
Naphthalene SCHEMBL28148380 0.89 AKR1B1 (0.67) HDAC11MAPTSMN1; SMN2LMNATSHR
Stearic Acid SCHEMBL29123159 0.87 GPR84 (0.68) CYP1A2HDAC11MAPTRXFP1LMNA
Decanoic Acid SCHEMBL31619443 0.87 GPR84 (0.68) CYP1A2HDAC11MAPTRXFP1LMNA
Stearic Acid SCHEMBL16632630 0.87 GPR84 (0.68) CYP1A2HDAC11MAPTRXFP1LMNA
Naphthalene SCHEMBL6898872 0.87 LMNA (0.68) CYP1A2HDAC3HDAC4HDAC1HDAC7
Myristic Acid SCHEMBL29097493 0.87 GPR84 (0.68) CYP1A2HDAC11MAPTRXFP1LMNA

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
CN-103382234-B Process for producing polypropylene PETROCHINA COMPANY LIMITED (CN) 2016-04-06 CN claimed
CN-113226642-A Polishing pad 株式会社可乐丽 2021-08-06 CN disclosed
CN-109678705-A Two acid esters compound of naphthalene and preparation method thereof and application as lubricating oil 宝鸡文理学院 2019-04-26 CN disclosed
CN-103382234-B Process for producing polypropylene PETROCHINA COMPANY LIMITED (CN) 2016-04-06 CN disclosed