SCHEMBL8465408

SCHEMBL8465408

CC(=O)OC1(O)CCCCC1C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.35
MAPT P10636 2/20 0.34
CYP2C19 P33261 1/20 0.33
CYP19A1 P11511 1/20 0.32
EP300 Q09472 1/20 0.31
HIF1A Q16665 1/20 0.31
CREBBP Q92793 1/20 0.31
HSD11B1 P28845 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL28976377 0.77 ALOX15 (0.37) ALOX15MAPK1MAPTEP300HIF1A
SCHEMBL28976380 0.77 ALOX15 (0.37) ALOX15MAPK1MAPTEP300HIF1A
SCHEMBL8089814 0.77 MAPK1 (0.37) ALOX15MAPK1MAPTCYP2C19EP300
SCHEMBL8098921 0.77 MAPK1 (0.37) ALOX15MAPK1MAPTCYP2C19EP300
SCHEMBL27519971 0.77 ALOX15 (0.37) ALOX15MAPK1MAPTEP300HIF1A
SCHEMBL867536 0.77 NPSR1 (0.35) MAPK1CYP2C19ACHE
Hydrochloric Acid SCHEMBL29069900 0.76 MAPK1 (0.36) ALOX15MAPK1MAPTEP300HIF1A
SCHEMBL11583591 0.74 ALOX15 (0.36) ALOX15MAPK1EP300HIF1ACREBBP
SCHEMBL27651835 0.74 HSD11B1 (0.36) CYP19A1EP300HIF1ACREBBPHSD11B1
SCHEMBL998437 0.72 ALOX15 (0.39) ALOX15MAPK1EP300HIF1ACREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0766660-B1 CYCLOHEXANONE DERIVATIVES, METHOD OF PREPARING THEM AND INTERMEDIATES USED IN THE METHOD SCHERING AG (DE) 1999-12-29 EP claimed