SCHEMBL9049550

SCHEMBL9049550

O=c1cc(CI)[nH]cc1O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APP P05067 6/20 0.39
TYR P14679 1/20 0.36
GAA P10253 1/20 0.34
DAO P14920 2/20 0.32
ADRA1A P35348 1/20 0.32
ERCC1 P07992 1/20 0.32
ERCC4 Q92889 1/20 0.32

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
SCHEMBL7934352 0.81 TYR (0.41) APPTYRGAADAO
SCHEMBL10892930 0.81 APP (0.40) APPTYRGAADAO
SCHEMBL13422405 0.79 DAO (0.45) APPTYRGAADAO
SCHEMBL4140429 0.79 TYR (0.39) APPTYRGAADAO
SCHEMBL9012918 0.75 APP (0.41) APPTYRGAADAO
SCHEMBL9012854 0.72 HTR2A (0.42) APPADRA1A
SCHEMBL14478190 0.72 APP (0.34) APPTYRGAADAOADRA1A
SCHEMBL1584769 0.72 DAO (0.53) APPTYRDAO
SCHEMBL16231972 0.72 APP (0.37) APPTYRDAO
SCHEMBL10895825 0.71

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0435333-B1 Cephalosporin derivatives, the process for preparing the same, and antimicrobial composition containing the derivatives OTSUKA PHARMA CO LTD (JP) 1996-06-05 EP disclosed
US-5262411-A Isocephem derivatives, and antimicrobial composition containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-11-16 US disclosed
EP-0435333-A2 Cephalosporin derivatives, the process for preparing the same, and antimicrobial composition containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-03 EP disclosed