SCHEMBL9413832

SCHEMBL9413832

Nc1cc2nc[nH]n2c(=S)n1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
EGLN2 Q96KS0 2/20 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
SCHEMBL9413833 0.72 ADK (0.42) KDM4E
SCHEMBL9413771 0.66 KDM5B (0.34) KDM4ENPSR1KDM5B
SCHEMBL9413800 0.64 NOS2 (0.31)
SCHEMBL8134754 0.63 KDM5B (0.64) KDM4EKDM5B
SCHEMBL9413828 0.59
SCHEMBL8871376 0.59 NOS3 (0.30)
SCHEMBL9413790 0.59 TYMP (0.34)
SCHEMBL8871239 0.57 NOS3 (0.33)
SCHEMBL9703916 0.57
SCHEMBL18261989 0.57 EGLN2 (0.49) KDM4EKDM5BEGLN2

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