SCHEMBL7412977

SCHEMBL7412977

OCCOC1c2c(O)cc(O)c(Br)c2O[C@H](c2ccc(O)c(O)c2)[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MMP2 P08253 4/20 0.38
▸ MMP9 P14780 4/20 0.38
▸ PRKD3 O94806 2/20 0.38
▸ PRKCG P05129 2/20 0.38
▸ PRKCB P05771 2/20 0.38
▸ PRKCA P17252 2/20 0.38
▸ PRKCH P24723 2/20 0.38
▸ PRKCI P41743 2/20 0.38
▸ PRKCE Q02156 2/20 0.38
▸ PRKCQ Q04759 2/20 0.38
▸ PRKCZ Q05513 2/20 0.38
▸ PRKCD Q05655 2/20 0.38
▸ PRKD1 Q15139 2/20 0.38
▸ PTGS1 P23219 1/20 0.37
▸ ALOX5 P09917 2/20 0.35
▸ PTPN1 P18031 1/20 0.35

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
SCHEMBL7413000 1.00 SNCA (0.39) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL6841019 0.80 HSD17B10 (0.49) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL6841020 0.80 HSD17B10 (0.49) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL7153501 0.70 PTGES (0.30) PTGES
SCHEMBL5360708 0.70 APP (0.34) —
SCHEMBL5532559 0.70 APP (0.34) —
SCHEMBL2529267 0.66 KDM4E (0.60) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL2529265 0.66 KDM4E (0.60) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL14380400 0.66 KDM4E (0.60) SNCACYP1A2ALOX15HSD17B10MMP2
SCHEMBL2535727 0.66 KDM4E (0.60) SNCACYP1A2ALOX15HSD17B10MMP2

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
EP-1027345-A1 SYNTHETIC METHODS FOR POLYPHENOLS Mars Incorporated (US) 2000-08-16 — — EP disclosed
WO-1999019319-A1 SYNTHETIC METHODS FOR POLYPHENOLS MARS INCORPORATED (US) 1999-04-22 — — WO disclosed
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