SCHEMBL9413841

SCHEMBL9413841

CC(O)n1c(N)nn2c(=S)nc(N)cc12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 2/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 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
SCHEMBL8871745 0.76
SCHEMBL9413772 0.68 CDK9 (0.33) NOS2NOS3NOS1
SCHEMBL9413794 0.68 LMNA (0.30)
SCHEMBL9413872 0.65
SCHEMBL8870165 0.62 DYRK1A (0.31)
SCHEMBL9413800 0.58 NOS2 (0.31) NOS2
SCHEMBL9413829 0.57 CYP3A4 (0.34)
SCHEMBL8871239 0.56 NOS3 (0.33) NOS2NOS3NOS1
SCHEMBL578294 0.54 NOS2 (0.32) NOS2NOS3NOS1
SCHEMBL9413828 0.54

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