SCHEMBL13199870

SCHEMBL13199870

CCCCCc1ncnc2[nH]c(=O)ccc12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.48
PDE3A Q14432 2/20 0.48
ENPP1 P22413 9/20 0.42
GPR84 Q9NQS5 4/20 0.42
MAPT P10636 1/20 0.40
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
UNG P13051 3/20 0.36

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
SCHEMBL12775794 0.89 PDE3B (0.59) PDE3BPDE3AENPP1
SCHEMBL12775783 0.83 PDE3B (0.57) PDE3BPDE3AENPP1
SCHEMBL13199873 0.79 ENPP1 (0.40) PDE3BPDE3AENPP1
SCHEMBL21715896 0.76 TTBK1 (0.45) GPR84
SCHEMBL27020416 0.76 TTBK1 (0.45) GPR84
SCHEMBL13199882 0.73 PDE3B (0.37) PDE3BPDE3AENPP1
SCHEMBL10813106 0.72 PDE3B (0.83) PDE3BPDE3AGPR84
SCHEMBL2015028 0.71 PDE3B (0.53) PDE3BPDE3AENPP1
SCHEMBL23326745 0.69 ENPP1 (0.44) PDE3BPDE3AENPP1PI4KAPI4K2B
SCHEMBL24671871 0.68 ENPP1 (0.42) PDE3BPDE3AENPP1

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
US-7767687-B2 Pyrido pyrimidinones, dihydro pyrimido pyrimidinones and pteridinones useful as RAF kinase inhibitors BIOGEN IDEC MA INC. (US) 2010-08-03 US disclosed