SCHEMBL16868833

SCHEMBL16868833

O=C(C=Cc1ccc(O)c(C(=O)O)c1)CC(=O)C=Cc1ccc(O)c(C(=O)O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.71
▸ PTPN2 P17706 1/20 0.71
▸ PTPN6 P29350 1/20 0.71
▸ HNF4A P41235 1/20 0.65
▸ PTGS2 P35354 3/20 0.63
▸ DHODH Q02127 1/20 0.60
▸ APP P05067 7/20 0.58
▸ BACE1 P56817 4/20 0.58
▸ CYP2D6 P10635 2/20 0.58
▸ CYP2C9 P11712 2/20 0.58
▸ TSHR P16473 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ TOP2A P11388 2/20 0.58
▸ MAPT P10636 2/20 0.58
▸ AKR1B1 P15121 2/20 0.58
▸ MAOB P27338 2/20 0.58
▸ GLO1 Q04760 2/20 0.58
▸ CAMK2A Q9UQM7 2/20 0.58
▸ CYP2C19 P33261 1/20 0.58
▸ LCK P06239 1/20 0.58

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
SCHEMBL14887101 1.00 PTPN1 (0.71) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL10892522 0.86 PTPN1 (0.76) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL9688131 0.86 PTPN1 (0.76) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL1048686 0.83 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL6266629 0.83 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL29938670 0.83 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL6266631 0.83 PTPN1 (1.00) PTPN1PTPN2PTPN6HNF4APTGS2
SCHEMBL14875129 0.82 PTGS2 (0.70) PTGS2APPBACE1CYP2D6CYP2C9
SCHEMBL14875128 0.82 PTGS2 (0.70) PTGS2APPBACE1CYP2D6CYP2C9
SCHEMBL699351 0.82 APP (0.71) PTPN1PTPN2PTPN6HNF4APTGS2

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
US-9074238-B2 Methods for enhancing neprilysin activity and degrading amyloid-beta peptides and oligomers in a subject with Alzheimer's disease ACADEMIA SINICA (TW) 2015-07-07 — — US disclosed
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