SCHEMBL5822876

SCHEMBL5822876

COC(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)C(=O)CC[C@@]45C[C@@]35CC[C@]12C)C(C)(C)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.59
▸ ACHE P22303 3/20 0.44
▸ HSD11B2 P80365 1/20 0.42
▸ ACLY P53396 2/20 0.42
▸ ACACA Q13085 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CRYAB P02511 1/20 0.41
▸ TOP2A P11388 6/20 0.40
▸ TOP2B Q02880 5/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ PRKAG1 P54619 1/20 0.38
▸ PRKAA2 P54646 1/20 0.38
▸ PRKAB1 Q9Y478 1/20 0.38
▸ CDC25B P30305 1/20 0.38

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
SCHEMBL5824299 0.88 HSD11B1 (0.61) HSD11B1ACHEHSD11B2ACLYACACA
SCHEMBL30741399 0.82 HSD11B1 (0.62) HSD11B1ACHEHSD11B2ACLYACACA
SCHEMBL31237297 0.81 HSD11B1 (0.82) HSD11B1ACHEACLYACACAMEN1
SCHEMBL5823474 0.80 HSD11B1 (0.57) HSD11B1ACHEHSD11B2ACLYACACA
SCHEMBL5824245 0.80 HSD11B1 (0.69) HSD11B1ACHEHSD11B2ACLYACACA
Cycloartenone SCHEMBL29504219 0.80 HSD11B1 (0.61) HSD11B1ACHEACLYACACAMEN1
SCHEMBL30020818 0.79 HSD11B1 (0.70) HSD11B1ACHEACLYACACAMEN1
SCHEMBL29934767 0.78 HSD11B1 (0.77) HSD11B1HSD11B2ACLYACACAMEN1
Mangiferonic Acid SCHEMBL30415919 0.77 ACLY (0.70) HSD11B1ACHEACLYACACAMEN1
Mangiferonic Acid SCHEMBL29873759 0.77 ACLY (0.70) HSD11B1ACHEACLYACACAMEN1

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
JP-2006131595-A CARCINOGENESIS PREVENTING AGENT AND METHOD FOR PREPARING CYCLOARTANE-TYPE TRITERPENE COMPOUND UNIV NIHON 2006-05-25 — — JP disclosed
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