SCHEMBL18290370

SCHEMBL18290370

COCC(=O)C1C(C)(C)CCC[C@]1(C)C1=C(O)C(=O)C(C(C)C)=CC1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 1/20 0.51
▸ FDPS P14324 11/20 0.48
▸ GGPS1 O95749 6/20 0.37
▸ CACNA1G O43497 1/20 0.34
▸ HIF1A Q16665 1/20 0.32
▸ EPAS1 Q99814 1/20 0.32
▸ CYP3A4 P08684 3/20 0.31
▸ TP53 P04637 2/20 0.31
▸ MAPT P10636 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ SMN1; SMN2 Q16637 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
Taxodione SCHEMBL3847860 0.68 EP300 (1.00) EP300FDPSGGPS1CACNA1GCYP3A4
Taxodione SCHEMBL23630260 0.68 EP300 (1.00) EP300FDPSGGPS1CACNA1GCYP3A4
SCHEMBL18290373 0.67 EP300 (0.66) EP300FDPSGGPS1CYP3A4TP53
SCHEMBL18290366 0.67 EP300 (0.66) EP300FDPSGGPS1CACNA1GCYP3A4
SCHEMBL29929294 0.67 EP300 (0.66) EP300FDPSGGPS1CYP3A4TP53
SCHEMBL15732245 0.65 EP300 (0.46) EP300FDPSGGPS1CACNA1GHIF1A
SCHEMBL8855191 0.61 KARS1 (0.53) CYP3A4TP53MAPTALDH1A1ALOX15
SCHEMBL8855131 0.61 KARS1 (0.51) EP300CYP3A4TP53MAPTALDH1A1
SCHEMBL22861880 0.59 EP300 (0.64) EP300FDPSGGPS1CYP3A4TP53
SCHEMBL29574656 0.58 FDPS (0.50) EP300FDPSGGPS1CYP3A4TP53

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
WO-2016192631-A1 ABIETANE-TYPE DITERPENE COMPOUND HAVING LIPID-LOWERING ACTIVITY, METHOD FOR PREPARING SAME, AND USE OF SAME 中国科学院上海药物研究所 2016-12-08 — — WO disclosed
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