SCHEMBL7735479

SCHEMBL7735479

CC(=O)C1(C(C)=O)CCCC2CCCCC21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.33
HSD17B10 Q99714 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
SCHEMBL75178 0.81 CYP2C19 (0.34) HSD11B1HSD17B10
Hydrochloric Acid SCHEMBL3684435 0.79 CYP2C19 (0.33) HSD11B1HSD17B10
SCHEMBL28486688 0.79 HSD11B1 (0.30) HSD11B1HSD17B10
SCHEMBL3118786 0.79 MAPT (0.38) HSD11B1HSD17B10
SCHEMBL3682440 0.74 KDM4E (0.39) HSD17B10
SCHEMBL5683465 0.73 MAPT (0.44) HSD11B1HSD17B10
SCHEMBL12918345 0.71 ALOX15 (0.40) HSD11B1
SCHEMBL27989170 0.70 CNR2 (0.41)
SCHEMBL27651835 0.69 HSD11B1 (0.36) HSD11B1HSD17B10
SCHEMBL31440758 0.69 HSD11B1 (0.33) HSD11B1HSD17B10

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-6429314-B1 USING 1,2-DICARBONYL DERIVATIVE OR ITS HYDROXY REDUCTIVE, OXYGEN, COBALT ACETATE METAL COMPOUND, AND N-HYDROXYPHTHALIMIDE OR OTHER IMIDE DERIVATIVE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-08-06 US disclosed