SCHEMBL28897641

SCHEMBL28897641

O=c1cc(C(O)C2CC2)occ1O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TYR P14679 4/20 0.43
DAO P14920 2/20 0.43
KDM4E B2RXH2 1/20 0.43
APP P05067 2/20 0.39

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
SCHEMBL10032702 0.71 TYR (0.51) TYRDAOKDM4EAPP
SCHEMBL28454887 0.70 KDM4E (0.34) KDM4E
SCHEMBL13593403 0.69
SCHEMBL9084566 0.64 APP (0.45) TYRDAOKDM4EAPP
SCHEMBL20626579 0.63
SCHEMBL9083710 0.62 APP (0.42) TYRDAOKDM4EAPP
SCHEMBL2491005 0.62 KDM4E (0.47) TYRDAOKDM4E
SCHEMBL3373529 0.62
SCHEMBL10290051 0.62 DAO (0.70) TYRDAOKDM4E
Kojic Acid SCHEMBL36895 0.60 TYR (1.00) TYRDAOKDM4E

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
CN-111620893-B C-3 tetrahydrofuran substituted cephalosporin-siderophore coupling compound and preparation method and application thereof 重庆医药高等专科学校 2021-12-14 CN disclosed
CN-111620893-A C-3 tetrahydrofuran substituted cephalosporin-siderophore coupling compound and preparation method and application thereof 重庆医药高等专科学校 2020-09-04 CN disclosed