SCHEMBL10632093

SCHEMBL10632093

CC(C)CCC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)CC=C(c5cccc([N+](=O)[O-])c5C(=O)O)[C@@]45C[C@@]35CC[C@]12C

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EBP Q15125 7/20 0.38
▸ ACLY P53396 2/20 0.35
▸ ACACA Q13085 2/20 0.35
▸ HMGCR P04035 2/20 0.34
▸ PRKAG1 P54619 1/20 0.34
▸ PRKAA2 P54646 1/20 0.34
▸ PRKAB1 Q9Y478 1/20 0.34
▸ HSD11B1 P28845 1/20 0.32
▸ CDC25B P30305 3/20 0.31
▸ CDC25A P30304 1/20 0.31
▸ PTPN11 Q06124 1/20 0.31
▸ FNTA P49354 1/20 0.30
▸ FNTB P49356 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
SCHEMBL10638415 0.89 EBP (0.40) EBPACLYACACAHMGCRPRKAG1
SCHEMBL10638470 0.89 EBP (0.38) EBPACLYACACAHMGCRPRKAG1
SCHEMBL10638401 0.88 EBP (0.41) EBPACLYACACAHMGCRPRKAG1
SCHEMBL10635626 0.87 EBP (0.39) EBPACLYACACAHMGCRPRKAG1
SCHEMBL10635500 0.86 EBP (0.38) EBPACLYACACAHMGCRHSD11B1
SCHEMBL10635634 0.85 PRKAG1 (0.37) EBPACLYACACAHMGCRPRKAG1
SCHEMBL10638467 0.80 EBP (0.38) EBPACLYACACAHMGCRHSD11B1
SCHEMBL10638570 0.80 EBP (0.40) EBPACLYACACAHMGCRHSD11B1
SCHEMBL10638617 0.80 EBP (0.41) EBPACLYACACAHMGCRHSD11B1
SCHEMBL10638347 0.80 EBP (0.40) EBPACLYACACAHMGCRHSD11B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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