Sebacic Acid

Sebacic Acid

SCHEMBL8405057

O=C(O)CCC(=O)O.O=C(O)CCCCCCCCC(=O)O

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRB1CDK4CDK6CHRM2CHRM3DPP4DRD2DRD3DRD4EGFRHRH1HTR1BHTR1DHTR1FHTR2AHTR2CHTR4SLC6A2SLC6A4

The experimentally established mechanism targets of Sebacic 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
SLC6A2 known ✓ P23975 1/20 0.67
TSHR P16473 5/20 0.92
LMNA P02545 4/20 0.92
NFKB1 P19838 1/20 0.92
PMP22 Q01453 1/20 0.92
SLC22A6 Q4U2R8 2/20 0.71
GPR84 Q9NQS5 8/20 0.71
FFAR1 O14842 2/20 0.71
FFAR4 Q5NUL3 2/20 0.71
ALKBH5 Q6P6C2 1/20 0.69
SUCNR1 Q9BXA5 1/20 0.69
EGLN1 Q9GZT9 1/20 0.69
PPARG P37231 6/20 0.67
PPARD Q03181 6/20 0.67
PPARA Q07869 6/20 0.67
HDAC11 Q96DB2 5/20 0.67
ALDH1A1 P00352 3/20 0.67
TLR2 O60603 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
MEN1 O00255 2/20 0.67

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
Pimelic Acid SCHEMBL100415 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Octanedioate SCHEMBL3852958 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Sebacic Acid SCHEMBL20594219 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Succinic Acid SCHEMBL28346539 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Azelaic Acid SCHEMBL10456758 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Succinic Acid SCHEMBL28059863 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Octanedioate SCHEMBL5800699 1.00 TSHR (0.92) TSHRLMNANFKB1PMP22SLC22A6
Octanedioate SCHEMBL28812368 0.96 TSHR (0.86) TSHRLMNANFKB1PMP22SLC22A6
Pimelic Acid SCHEMBL28069641 0.96 TSHR (0.86) TSHRLMNANFKB1PMP22SLC22A6
Octanedioate SCHEMBL28269347 0.96 TSHR (0.86) TSHRLMNANFKB1PMP22SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180208787-A1 AQUEOUS PIGMENT DISPERSION, METHOD FOR PRODUCING SAME, COLORING COMPOSITION, INK COMPOSITION, INK COMPOSITION FOR INKJET RECORDING, AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2018-07-26 US disclosed
US-20170335054-A1 HEAT RESISTANT POLYETHYLENE TEREPHTHALATE AND PROCESS OF MANUFACTURING THEREOF ESTER INDUSTRIES LIMITED (IN) 2017-11-23 US disclosed
EP-3221400-A2 HEAT RESISTANT POLYETHYLENE TEREPHTHALATE AND PROCESS OF MANUFACTURING THEREOF Ester Industries Limited (IN) 2017-09-27 EP disclosed
CN-105324108-A Composition for treating complications of aneurysmal subarachnoid hemorrhage and application thereof EDGE THERAPEUTICS INC 2016-02-10 CN disclosed
EP-2699485-A1 CELLULOSIC BARRIER PACKAGING MATERIAL BASF SE (DE) 2014-02-26 EP disclosed
WO-2012143323-A1 CELLULOSIC BARRIER PACKAGING MATERIAL BASF SE (DE) 2012-10-26 WO disclosed
EP-0927019-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MedLogic Global Corporation (US) 1999-07-07 EP disclosed
WO-1998048768-A1 COMPOSITIONS FOR COSMETIC APPLICATIONS MEDLOGIC GLOBAL CORPORATION (US) 1998-11-05 WO disclosed