SCHEMBL10350142

SCHEMBL10350142

C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CCC(c5c(N)cccc5C(=O)O)[C@@]45C[C@@]35CC[C@]12C)C(C)C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 8/20 0.46
▸ ACLY P53396 2/20 0.36
▸ ACACA Q13085 2/20 0.36
▸ PTPN11 Q06124 1/20 0.34
▸ ESR2 Q92731 2/20 0.33
▸ EBP Q15125 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TOP2A P11388 1/20 0.31
▸ PTPN1 P18031 1/20 0.30
▸ HSD11B2 P80365 1/20 0.30
▸ ESR1 P03372 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
SCHEMBL23780405 0.74 MEN1 (0.49) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL10634947 0.71 HSD11B1 (0.45) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL10350159 0.69 MEN1 (0.45) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL13420339 0.68 HSD11B1 (0.53) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL464758 0.67 HSD11B1 (0.49) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL23791003 0.66 MEN1 (0.58) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL10349862 0.66 MEN1 (0.43) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL13455191 0.66 ACLY (0.63) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL1878720 0.66 ACLY (0.63) HSD11B1ACLYACACAPTPN11ESR2
SCHEMBL11408854 0.66 ACLY (0.63) HSD11B1ACLYACACAPTPN11ESR2

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-0166542-B1 TRITERPENYL ESTERS OF ORGANIC ACIDS, PROCESS FOR THEIR PRODUCTION, AND HYPOLIPIDEMIC AGENTS COMPOSED OF THEM AMANO PHARMACEUTICAL CO., LTD. (JP) 1990-08-08 — — EP claimed
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