SCHEMBL76391

SCHEMBL76391

CCC1(CC)CC(C(CCCCCCCC(=O)O)(C(=O)O)C2CC(CC)(CC)NC(CC)(CC)C2)CC(CC)(CC)N1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.37
PPARG P37231 7/20 0.37
PPARD Q03181 7/20 0.37
PPARA Q07869 7/20 0.37
HDAC11 Q96DB2 5/20 0.37
TSHR P16473 5/20 0.37
PTPN1 P18031 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
KMT2A Q03164 2/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
MEN1 O00255 1/20 0.37
ESR1 P03372 1/20 0.37
ALOX15 P16050 1/20 0.37
PDE4A P27815 1/20 0.37
PDE3A Q14432 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL9577593 0.92 GPR84 (0.33) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2533732 0.88 GPR84 (0.41) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL2573155 0.87 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL9577536 0.87 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL9577728 0.85 GAA (0.38) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL434149 0.85 GAA (0.38) GPR84PPARGPPARDPPARAHDAC11
Sebacic Acid SCHEMBL28872453 0.85 GAA (0.38) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL431527 0.85 GAA (0.38) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL35143 0.85 GAA (0.38) GPR84PPARGPPARDPPARAHDAC11
Ammonia Solution, Strong SCHEMBL407292 0.84 GAA (0.37) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1994007489-A1 NON-COMPETITIVE INHIBITORS OF NEURONAL NICOTINIC ACETYLCHOLINE RECEPTORS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1994-04-14 WO claimed
US-11674037-B2 Composition, and flame-retardant resin composition ADEKA CORPORATION (JP) 2023-06-13 US disclosed
US-20200165448-A1 COMPOSITION, AND FLAME-RETARDANT RESIN COMPOSITION ADEKA CORPORATION (JP) 2020-05-28 US disclosed
EP-3428246-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-04-15 EP disclosed
EP-3421569-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2020-03-11 EP disclosed
EP-3428246-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-01-16 EP disclosed
EP-3421569-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2019-01-02 EP disclosed
EP-2957618-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2018-08-01 EP disclosed
EP-2957618-A1 LIQUID CRYSTALLINE MEDIUM Merck Patent GmbH (DE) 2015-12-23 EP disclosed
EP-2216828-B1 SEALING FILM FOR SOLAR CELL AND SOLAR CELL OBTAINED BY USE OF THE SEALING FILM BRIDGESTONE CORP (JP) 2013-11-20 EP disclosed
US-8129451-B2 Sealing film for solar cell and solar cell obtained by use of the sealing film BRIDGESTONE CORPORATION (JP) 2012-03-06 US disclosed
US-20100286315-A1 SEALING FILM FOR SOLAR CELL AND SOLAR CELL OBTAINED BY USE OF THE SEALING FILM BRIDGESTONE CORPORATION (JP) 2010-11-11 US disclosed
EP-2216828-A1 SEALING FILM FOR SOLAR CELL AND SOLAR CELL USING THE SAME Bridgestone Corporation (JP) 2010-08-11 EP disclosed