Adipic Acid

Adipic Acid

SCHEMBL8533918

Cc1cccc(C)c1N.Cc1cccc(C)c1N.O=C(O)CCCCC(=O)O

nearest known ligand 0.51

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 0.44
TSHR P16473 2/20 0.46
HDAC3 O15379 3/20 0.46
HDAC4 P56524 3/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC7 Q8WUI4 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC10 Q969S8 3/20 0.46
HDAC11 Q96DB2 3/20 0.46
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC9 Q9UKV0 3/20 0.46
HDAC5 Q9UQL6 3/20 0.46
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
CD44 P16070 1/20 0.45
LMNA P02545 2/20 0.44
FFAR1 O14842 2/20 0.44
MAPK1 P28482 1/20 0.44
ADRA1A P35348 1/20 0.44

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
SCHEMBL27903702 0.86 CD44 (0.46) HDAC3HDAC4HDAC1HDAC7HDAC2
Propionic Acid SCHEMBL28079058 0.83 CD44 (0.48) MAPTCD44LMNAFFAR1MAPK1
Adipic Acid SCHEMBL647718 0.83 TSHR (0.46) TSHRHDAC3HDAC4HDAC1HDAC7
Adipic Acid SCHEMBL21332433 0.83 HDAC3 (0.57) TSHRHDAC3HDAC4HDAC1HDAC7
Adipic Acid SCHEMBL27731399 0.83 HDAC3 (0.57) TSHRHDAC3HDAC4HDAC1HDAC7
Sebacic Acid SCHEMBL28279616 0.81 HDAC11 (0.61) TSHRHDAC3HDAC4HDAC1HDAC7
Adipic Acid SCHEMBL28584893 0.81 TSHR (0.51) TSHRHDAC3HDAC4HDAC1HDAC7
Azelaic Acid SCHEMBL28393484 0.79 HDAC3 (0.50) TSHRHDAC3HDAC4HDAC1HDAC7
Sebacic Acid SCHEMBL28395117 0.79 HDAC3 (0.50) TSHRHDAC3HDAC4HDAC1HDAC7
Adipic Acid SCHEMBL15167368 0.79 TSHR (0.53) TSHRHDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5973076-A MOLDING; CONTROLLING TEMPERATURE IN PRESENCE OF AN AMIDE COMPOUND NEW JAPAN CHEMICAL CO., LTD. (JP) 1999-10-26 US claimed
EP-0776933-B1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEM CO LTD (JP) 1999-08-04 EP claimed
EP-0776933-A1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEMICAL CO.,LTD. (JP) 1997-06-04 EP claimed
US-5973076-A MOLDING; CONTROLLING TEMPERATURE IN PRESENCE OF AN AMIDE COMPOUND NEW JAPAN CHEMICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0776933-B1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEM CO LTD (JP) 1999-08-04 EP disclosed
EP-0776933-A1 Polybutene-1 resin composition and a method of accelerating the crystal transformation NEW JAPAN CHEMICAL CO.,LTD. (JP) 1997-06-04 EP disclosed