SCHEMBL9847378

SCHEMBL9847378

CCCCCCCCCCCCCCCCCCC(Cc1ccc(O)c(C(C)(C)C)c1C(C)(C)C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.41
GRIK2 Q13002 2/20 0.41
FOLH1 Q04609 2/20 0.40
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
PTGES O14684 2/20 0.38
ALOX5 P09917 2/20 0.38
PPARG P37231 2/20 0.38
CA2 P00918 1/20 0.38
MAPK1 P28482 1/20 0.38
HDAC8 Q9BY41 4/20 0.38
HDAC3 O15379 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
GAA P10253 1/20 0.38
XBP1 P17861 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38

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
SCHEMBL11462840 0.85 GRIK1 (0.40) GRIK1GRIK2FOLH1SLC1A2SLC1A1
SCHEMBL12301090 0.78 ALOX5 (0.48) GRIK1GRIK2FOLH1SLC1A2SLC1A1
SCHEMBL18192968 0.76 GAA (0.43) GRIK1GRIK2FOLH1SLC1A2SLC1A1
SCHEMBL604340 0.75 GAA (0.50) GRIK1GRIK2FOLH1PTGESALOX5
SCHEMBL11495521 0.75 TYR (0.56) ALOX5PPARGMAPTLCK
SCHEMBL14351587 0.75 GRIK1 (0.38) GRIK1GRIK2FOLH1SLC1A2SLC1A1
SCHEMBL11114655 0.74 PPARG (0.42) GRIK1GRIK2FOLH1SLC1A2SLC1A1
SCHEMBL2901961 0.73 SLC1A3 (0.33) FOLH1SLC1A2SLC1A1
SCHEMBL9325691 0.73 KMT2A (0.56) GRIK1GRIK2FOLH1PTGESALOX5
SCHEMBL10960336 0.71 FOLH1 (0.66) FOLH1PTGESALOX5PPARG

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
EP-4363478-A1 PRODUCTION OF PU FOAMS USING RECYCLED POLYOLS Evonik Operations GmbH (DE) 2024-05-08 EP claimed
WO-2023275035-A1 PRODUCTION OF PU FOAMS USING RECYCLED POLYOLS EVONIK OPERATIONS GMBH (DE) 2023-01-05 WO claimed
WO-2019172013-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION 住友化学株式会社 2019-09-12 WO disclosed
EP-0426145-A1 Organic peroxide and organic sulfide antioxidant composition ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-05-08 EP disclosed