SCHEMBL9413833

SCHEMBL9413833

Nc1cc2nc(N)[nH]n2c(=S)n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.42
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP3A4 P08684 1/20 0.31
BLM P54132 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL9413800 0.75 NOS2 (0.31)
SCHEMBL9413832 0.72 KDM4E (0.32) KDM4E
SCHEMBL9413790 0.63 TYMP (0.34) CYP3A4BLMMAPT
SCHEMBL9413829 0.60 CYP3A4 (0.34) CYP3A4BLM
SCHEMBL8871376 0.60 NOS3 (0.30) MAPT
SCHEMBL8871239 0.58 NOS3 (0.33)
SCHEMBL9703916 0.58
SCHEMBL7563426 0.57
SCHEMBL32665720 0.57
SCHEMBL9413828 0.57

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
EP-0582261-A1 Cephalosporin compounds and processes for the preparation thereof LUCKY LTD. (KR) 1994-02-09 EP disclosed