SCHEMBL10350179

SCHEMBL10350179

C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CCC(OC(=O)c5cccc(N)c5)[C@@]45C[C@@]35CC[C@]12C)C(C)C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 6/20 0.45
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ACLY P53396 2/20 0.33
▸ ACACA Q13085 2/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ PRKCG P05129 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ NR1H4 Q96RI1 1/20 0.31
▸ NT5E P21589 1/20 0.31
▸ EBP Q15125 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31

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
SCHEMBL10350159 0.84 MEN1 (0.45) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL23780405 0.80 MEN1 (0.49) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL13420339 0.80 HSD11B1 (0.53) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL10634947 0.78 HSD11B1 (0.45) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL10349531 0.77 MEN1 (0.48) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL10350142 0.77 HSD11B1 (0.46) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL568813 0.75 HSD11B1 (0.50) HSD11B1ACLYACACAPTPN1PTPN11
SCHEMBL10349862 0.74 MEN1 (0.43) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL13420513 0.70 HSD11B1 (0.54) HSD11B1MEN1KMT2AACLYACACA
SCHEMBL13420642 0.70 HSD11B1 (0.54) HSD11B1MEN1KMT2AACLYACACA

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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