SCHEMBL16731442

SCHEMBL16731442

O=C(OC[C@H]1OC(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)C(OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.67
▸ F11 P03951 2/20 0.60
▸ USP2 O75604 2/20 0.60
▸ CA1 P00915 2/20 0.60
▸ CA2 P00918 2/20 0.60
▸ MAPK1 P28482 2/20 0.60
▸ TMPRSS2 O15393 1/20 0.60
▸ PDE5A O76074 1/20 0.60
▸ HMGCR P04035 1/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ LCK P06239 1/20 0.60
▸ FYN P06241 1/20 0.60
▸ HSPD1 P10809 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CA6 P23280 1/20 0.60
▸ TBXAS1 P24557 1/20 0.60
▸ MAPK3 P27361 1/20 0.60
▸ HSPE1 P61604 1/20 0.60
▸ MAPK14 Q16539 1/20 0.60
▸ TST Q16762 1/20 0.60

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
SCHEMBL7642894 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL18083458 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL7144957 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL7251000 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL19479105 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL12326369 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL3785587 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL18068260 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL7642890 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2
SCHEMBL17633988 1.00 PTPN1 (0.67) PTPN1F11USP2CA1CA2

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-2015070571-A1 DISACCHARIDE INTERMEDIATE AND SYNTHESIS METHOD THEREOF 浙江海正药业股份有限公司 2015-05-21 — — WO disclosed
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