SCHEMBL28047857

SCHEMBL28047857

COC(=O)[C@H](CO)NCc1c(OC)cc(OC)cc1OC

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.47
CD274 Q9NZQ7 13/20 0.44
PDCD1 Q15116 5/20 0.44

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
SCHEMBL28047858 1.00 PTPN1 (0.47) PTPN1CD274PDCD1
SCHEMBL28047787 0.88 CD274 (0.55) PTPN1CD274PDCD1
SCHEMBL28047785 0.88 CD274 (0.55) PTPN1CD274PDCD1
SCHEMBL28047814 0.86 PTPN1 (0.45) PTPN1CD274PDCD1
SCHEMBL28047850 0.86 PTPN1 (0.45) PTPN1CD274PDCD1
SCHEMBL28047691 0.83 PTPN1 (0.43) PTPN1CD274PDCD1
SCHEMBL28047689 0.83 PTPN1 (0.43) PTPN1CD274PDCD1
SCHEMBL28047711 0.82 PTPN1 (0.49) PTPN1CD274PDCD1
SCHEMBL28047708 0.82 PTPN1 (0.49) PTPN1CD274PDCD1
SCHEMBL31649081 0.82 APLNR (0.55) CD274PDCD1

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
CN-105189446-A Phloroglucinol derivatives and application thereof in treatment of neurodegenerative disorder INST MATERIA MEDICA CAMS 2015-12-23 CN disclosed