SCHEMBL14380393

SCHEMBL14380393

CC(=O)Oc1ccc(C2Oc3c(c(OC(C)=O)cc(OC(C)=O)c3C3c4c(O)cc(O)cc4OC(c4ccc(O)c(O)c4)C3O)CC2OC(C)=O)cc1OC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 4/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ MMP2 P08253 6/20 0.55
▸ MMP9 P14780 4/20 0.55
▸ PRKD3 O94806 4/20 0.55
▸ PRKCG P05129 4/20 0.55
▸ PRKCB P05771 4/20 0.55
▸ PRKCA P17252 4/20 0.55
▸ PRKCH P24723 4/20 0.55
▸ PRKCI P41743 4/20 0.55
▸ PRKCE Q02156 4/20 0.55
▸ PRKCQ Q04759 4/20 0.55
▸ PRKCZ Q05513 4/20 0.55
▸ PRKCD Q05655 4/20 0.55
▸ PRKD1 Q15139 4/20 0.55
▸ PTGS1 P23219 1/20 0.54
▸ CYP3A4 P08684 2/20 0.53
▸ ALDH1A1 P00352 1/20 0.53

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
SCHEMBL14380394 0.84 ALDH1A1 (0.48) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL14403950 0.83 ALDH1A1 (0.49) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL27886444 0.79 CYP3A4 (0.66) SNCAALOX15HSD17B10MMP2PRKD3
SCHEMBL27886442 0.79 CYP3A4 (0.66) SNCAALOX15HSD17B10MMP2PRKD3
SCHEMBL30834898 0.77 PRKD3 (0.85) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL30834797 0.77 PRKD3 (0.85) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL30538719 0.77 PRKD3 (0.85) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL29437883 0.77 PRKD3 (0.85) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL22295330 0.77 PRKD3 (0.85) SNCAALOX15HSD17B10CYP1A2MMP2
SCHEMBL14690886 0.77 BACE1 (0.73) SNCAALOX15HSD17B10MMP2PRKD3

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-7282598-B2 Synthetic methods for preparing procyanidin oligomers MARS, INC. 2007-10-16 — — US disclosed
US-7282598-B2 Synthetic methods for preparing procyanidin oligomers MARS, INC. 2007-10-16 — — US disclosed
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