SCHEMBL12101264

SCHEMBL12101264

CCn1cc(-c2cnc3ccc(Cc4nnc5ccc(N(C)C)nn45)cc3c2)cn1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.60
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40

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
SCHEMBL3587632 0.89 MET (0.62) METPDE3BPDE3A
SCHEMBL12049212 0.88 MET (0.53) MET
SCHEMBL12049818 0.81 MET (0.49) METPDE3BPDE3A
SCHEMBL12049211 0.81 MET (0.54) METPDE3BPDE3A
SCHEMBL12049823 0.79 MET (0.47) METPDE3BPDE3A
SCHEMBL14198925 0.79 MET (0.65) MET
SCHEMBL3593536 0.79 MET (0.51) METPDE3BPDE3A
SCHEMBL12049836 0.78 MET (0.46) METPDE3BPDE3A
SCHEMBL12049185 0.78 MET (0.46) METPDE3BPDE3A
SCHEMBL12049191 0.77 MET (0.49) METPDE3BPDE3A

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-2081937-B1 TRIAZOLOPYRIDAZINE PROTEIN KINASE MODULATORS SGX PHARMACEUTICALS INC (US) 2012-09-12 EP disclosed