SCHEMBL9007399

SCHEMBL9007399

COC(OC)N1CCS/C1=N/C#N

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.38
PDE4D Q08499 10/20 0.38
MEN1 O00255 1/20 0.35
CHRNA7 P36544 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL9007406 1.00 PDE4B (0.38) PDE4BPDE4DMEN1CHRNA7KMT2A
SCHEMBL2755010 0.82 MEN1 (0.38) PDE4BPDE4DMEN1CHRNA7KMT2A
SCHEMBL3222391 0.71
SCHEMBL11033144 0.71
SCHEMBL11033145 0.71
SCHEMBL24044988 0.67
SCHEMBL17604960 0.67 MEN1 (0.39) PDE4BPDE4DMEN1CHRNA7KMT2A
SCHEMBL17604958 0.67 MEN1 (0.39) PDE4BPDE4DMEN1CHRNA7KMT2A
SCHEMBL17686523 0.67
SCHEMBL13684176 0.67 MEN1 (0.37) PDE4BPDE4DMEN1CHRNA7KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8099965-A None JP disclosed
JP-H0899965-A 2-(N-CYANOIMINO)THIAZOLIDINE DERIVATIVE AND SYNTHESIS OF TRIAZINE DERIVATIVE USING THE SAME SUNTORY LTD 1996-04-16 JP disclosed