SCHEMBL10349862

SCHEMBL10349862

C=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CCC(OC(=O)/C(C)=C/c5ccc(OC(=O)CC)c(OC)c5)[C@@]45C[C@@]35CC[C@]12C)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HSD11B1 P28845 5/20 0.40
▸ ACLY P53396 2/20 0.34
▸ ACACA Q13085 2/20 0.34
▸ PTPN11 Q06124 1/20 0.34
▸ FGFR1 P11362 1/20 0.33
▸ ESR2 Q92731 1/20 0.32
▸ HPGD P15428 5/20 0.32
▸ VCP P55072 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ PTGS2 P35354 1/20 0.30
▸ PTPN1 P18031 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
SCHEMBL10349699 0.91 MEN1 (0.52) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10350160 0.85 HSD11B1 (0.44) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10350159 0.83 MEN1 (0.45) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10349531 0.78 MEN1 (0.48) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL23780405 0.76 MEN1 (0.49) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10049047 0.75 KMT2A (0.67) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10350179 0.74 HSD11B1 (0.45) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL6438953 0.71 MEN1 (0.76) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL23484310 0.71 MEN1 (0.76) MEN1KMT2AHSD11B1ACLYACACA
SCHEMBL10017449 0.71 MEN1 (0.63) MEN1KMT2AHSD11B1ACLYACACA

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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