SCHEMBL9409107

SCHEMBL9409107

CCNc1cc(N)nc(=S)n1C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.33
NOS2 P35228 2/20 0.33
NOS1 P29475 1/20 0.33
HRH4 Q9H3N8 1/20 0.32
NLRP3 Q96P20 1/20 0.32
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL9409150 0.80
SCHEMBL8871239 0.71 NOS3 (0.33) NOS3NOS2NOS1HRH4
SCHEMBL9409277 0.66 DYRK1A (0.32)
SCHEMBL9021593 0.64 POLB (0.38) NOS3NOS2NOS1MAPT
SCHEMBL7112477 0.63 NOS2 (0.34) NOS3NOS2NOS1MAPT
SCHEMBL9409361 0.62 KMT2A (0.47)
SCHEMBL5175197 0.62 MAPK1 (0.32) MAPTMAPK1
SCHEMBL5485807 0.61
SCHEMBL10102121 0.61 TLR8 (0.47) NOS3NOS2NOS1HRH4MAPT
SCHEMBL9409243 0.60 KDM4E (0.39)

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-0584797-A2 Novel cephalosporin compounds and processes for the preparation thereof LUCKY LTD. (KR) 1994-03-02 EP disclosed