SCHEMBL7668284

SCHEMBL7668284

Nc1nc(Cl)c(NC=O)c(NC2C=CC(CO)C2)n1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.37
ALB P02768 1/20 0.37
PDE4D Q08499 1/20 0.37
IRAK4 Q9NWZ3 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
SCHEMBL5117081 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL14048880 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL14049050 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL4980169 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL331086 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL4980179 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL31454809 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL9842434 0.83
SCHEMBL8446237 0.83
SCHEMBL8446236 0.83

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
US-6448402-B2 REDUCTION OF 2-AZABICYCLO(2.2.1)HEPT-5-EN-3-ONE USING METAL HYRIDE LONZA AG (CH) 2002-09-10 US claimed
US-6252112-B1 MIBCROBIAL HYDROLYSIS OF THE TITLE COMPOUND DERIVATIVE USING ENZYME HAVING N-ACETYLAMINO-ALCOHOL HYDROLASE OR PENICILLIN G ACYLASE ACTIVITY WITH SUBSEQUENT ACYLATION LONZA A.G., (CH) 2001-06-26 US disclosed
US-6087501-A Chloropyrimidine intermediates and processes for their preparation GLAXO WELLCOME INC. (US) 2000-07-11 US disclosed