SCHEMBL11295045

SCHEMBL11295045

CC(C)OC(=O)C1(CCCCOCc2ccc(F)cc2)CO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
ABCB11 O95342 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.37
KMT2A Q03164 1/20 0.36
MAOB P27338 3/20 0.34
MAOA P21397 1/20 0.34
GBA1 P04062 1/20 0.34
UGCG Q16739 1/20 0.34
GBA2 Q9HCG7 1/20 0.34
RAB9A P51151 1/20 0.34
PSMB11 A5LHX3 1/20 0.33
PSMD11 O00231 1/20 0.33
PSMD12 O00232 1/20 0.33
PSMD14 O00487 1/20 0.33
PSMA7 O14818 1/20 0.33
PSMD3 O43242 1/20 0.33
PSMC3 P17980 1/20 0.33
PSMB1 P20618 1/20 0.33

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
SCHEMBL11016516 0.82 NPSR1 (0.35) LMNAMAPTNPSR1KMT2AMAOB
SCHEMBL11272047 0.79 NPSR1 (0.43) LMNAMAPTMAPK1NPSR1KMT2A
SCHEMBL11297976 0.77 MAPT (0.41) LMNAMAPTABCB11MAPK1RAB9A
SCHEMBL11299822 0.76 ABCB11 (0.42) LMNAMAPTABCB11MAPK1RAB9A
SCHEMBL11272688 0.73 ABCB11 (0.52) LMNAMAPTABCB11MAPK1KMT2A
SCHEMBL11269019 0.72 ABCB11 (0.48) LMNAMAPTABCB11MAPK1KMT2A
SCHEMBL11071353 0.72 ABCB11 (0.38) LMNAMAPTABCB11MAPK1
SCHEMBL11080432 0.72 SPHK1 (0.36) LMNAMAPTABCB11MAPK1
SCHEMBL7578766 0.72 LMNA (0.60) LMNAMAPTABCB11MAPK1KMT2A
SCHEMBL11289727 0.72 ABCB11 (0.73) LMNAMAPTABCB11MAPK1KMT2A

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-4337267-A HYPOKETONEMIC, HYPOGLYCEMIC, ANTIDIABETIC BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-06-29 US disclosed