SCHEMBL23601745

SCHEMBL23601745

CN(c1cccc(CF)c1)c1nc(=N)n(C=N)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.36
PDGFRB P09619 2/20 0.34
PDE5A O76074 2/20 0.33
EGFR P00533 3/20 0.32
KDR P35968 2/20 0.32
CLK1 P49759 1/20 0.32
CLK2 P49760 1/20 0.32
DYRK1A Q13627 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
DYRK1B Q9Y463 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
HDAC1 Q13547 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
SCHEMBL23601230 0.90 SIGMAR1 (0.41) ABCG2PDGFRBPDE5AEGFRKDR
SCHEMBL23600997 0.87 PDGFRB (0.34) ABCG2PDGFRBPDE5AEGFRKDR
SCHEMBL23601204 0.79 KDM4C (0.38) ABCG2PDE5ACLK1CLK2DYRK1A
SCHEMBL23601333 0.77 ADORA3 (0.35) ABCG2PDE5ACLK1CLK2DYRK1A
SCHEMBL23601809 0.77 LMNA (0.41) PDGFRBPDE5AEGFRKDR
SCHEMBL23600980 0.77 EGFR (0.36) ABCG2PDGFRBPDE5AEGFRKDR
SCHEMBL29909821 0.75 SMN1; SMN2 (0.37) ABCG2PDGFRBPDE5AEGFRKDR
SCHEMBL23577471 0.75 SMN1; SMN2 (0.37) ABCG2PDGFRBPDE5AEGFRKDR
SCHEMBL23601500 0.75 KCNA3 (0.32) PDE5A
SCHEMBL23601069 0.75 PDE5A (0.37) PDGFRBPDE5AEGFRKDRDYRK1A

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
WO-2021130638-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS CARNA BIOSCIENCES, INC. (JP) 2021-07-01 WO disclosed