SCHEMBL7865849

SCHEMBL7865849

CCCCCCCCCCC(CC)C(=O)N(O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.50
MAPK1 P28482 1/20 0.50
CA1 P00915 4/20 0.48
GRIK1 P39086 2/20 0.44
GRIK2 Q13002 2/20 0.44
GPR84 Q9NQS5 4/20 0.44
FFAR1 O14842 1/20 0.44
MAPT P10636 1/20 0.42
LCK P06239 1/20 0.42
PPARD Q03181 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
SLC1A2 P43004 1/20 0.42
SLC1A1 P43005 1/20 0.42

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
Phosphoric Acid SCHEMBL28692530 0.93 FDPS (0.47) CA2MAPK1CA1
Phosphoric Acid SCHEMBL28687898 0.93 FDPS (0.47) CA2MAPK1CA1
SCHEMBL7037548 0.90 TERT (0.46) FFAR1MAPTPPARD
SCHEMBL11413948 0.90 TERT (0.46) FFAR1MAPTPPARD
SCHEMBL2701947 0.86 ALDH1A1 (0.50) FFAR1MAPTPPARD
SCHEMBL29144960 0.82 CA2 (0.48) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL28667575 0.82 FFAR4 (0.51) CA2GPR84FFAR1PPARD
SCHEMBL28667494 0.82 FFAR4 (0.51) CA2GPR84FFAR1PPARD
SCHEMBL28680981 0.82 FFAR4 (0.51) CA2GPR84FFAR1PPARD
SCHEMBL28931343 0.80 CA2 (0.43) CA2GRIK1GRIK2GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0746311-B1 MEDICINAL PATCHES FOR PERCUTANEOUS ADMINISTRATION PACIFIC CORP (KR) 2001-07-11 EP claimed
CN-116590714-A Environment-friendly electrolyte-resistant surfactant 东莞市精诚环保科技有限公司 2023-08-15 CN disclosed
EP-0686877-A1 COLORED PHOTOSENSITIVE RESIN COMPOSITION HOECHST JAPAN LIMITED (JP) 1995-12-13 EP disclosed