SCHEMBL10349688

SCHEMBL10349688

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

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 9/20 0.50
▸ ACLY P53396 2/20 0.39
▸ ACACA Q13085 2/20 0.39
▸ ESR2 Q92731 1/20 0.38
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ NR1H3 Q13133 1/20 0.35
▸ PTPN1 P18031 3/20 0.35
▸ HSD11B2 P80365 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 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
SCHEMBL568813 0.81 HSD11B1 (0.50) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL982765 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL1878720 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL13801861 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL14047057 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL13420256 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL12152345 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL14520017 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL1878721 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1
SCHEMBL11408854 0.78 ACLY (0.63) HSD11B1ACLYACACAESR2PTGS1

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 4 patents. 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
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 disclosed
US-4748161-A Triterpenyl esters of organic acids and hypolipidemic agents composed of them AMANO PHARMACEUTICAL CO., LTD. (JP) 1988-05-31 — — US disclosed
EP-0166542-A2 Triterpenyl esters of organic acids, process for their production, and hypolipidemic agents composed of them AMANO PHARMACEUTICAL CO., LTD. (JP) 1986-01-02 — — EP disclosed
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