SCHEMBL8675008

SCHEMBL8675008

CC(=O)O[C@H]1CCC[C@@]1(C)OC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
CYP3A4 P08684 1/20 0.38
EP300 Q09472 1/20 0.36
HIF1A Q16665 1/20 0.36
CREBBP Q92793 1/20 0.36
ACHE P22303 1/20 0.35
HSD11B1 P28845 2/20 0.33
CYP19A1 P11511 7/20 0.32
F10 P00742 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL8444775 0.95 ALOX15 (0.39) ALOX15CYP3A4EP300HIF1ACREBBP
SCHEMBL8674651 0.93 ALOX15 (0.38) ALOX15CYP3A4EP300HIF1ACREBBP
SCHEMBL3677682 0.80 ALOX15 (0.39) ALOX15CYP3A4ACHEHSD11B1CYP19A1
SCHEMBL3677681 0.80 ALOX15 (0.39) ALOX15CYP3A4ACHEHSD11B1CYP19A1
SCHEMBL4050750 0.75 EP300 (0.35) ALOX15CYP3A4EP300HIF1ACREBBP
SCHEMBL12918345 0.74 ALOX15 (0.40) ALOX15EP300HIF1ACREBBPHSD11B1
SCHEMBL3670483 0.74 FNTA (0.38) ALOX15CYP3A4CYP19A1F10
SCHEMBL3670481 0.74 FNTA (0.38) ALOX15CYP3A4CYP19A1F10
SCHEMBL3670501 0.74 F10 (0.36) ALOX15CYP3A4CYP19A1F10
SCHEMBL3670498 0.74 F10 (0.36) ALOX15CYP3A4CYP19A1F10

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
US-5783602-A Leukotriene-B4 derivatives, process for their production and their use as pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1998-07-21 US disclosed