SCHEMBL20775404

SCHEMBL20775404

Cc1cc(Br)c2n[nH]c(=O)n2c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 18/20 0.45
GSK3B P49841 18/20 0.45
PDE5A O76074 1/20 0.40
NOTUM Q6P988 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
SCHEMBL13824973 0.79 GSK3A (0.50) GSK3AGSK3BNOTUM
SCHEMBL20772917 0.76 L3MBTL1 (0.41) GSK3AGSK3BPDE5ANOTUM
SCHEMBL13824875 0.74 GSK3A (0.42) GSK3AGSK3B
SCHEMBL12083969 0.71 LTK (0.38) GSK3AGSK3BPDE5ANOTUM
SCHEMBL1855620 0.69 LTK (0.60) GSK3AGSK3BPDE5A
SCHEMBL25367614 0.69 GSK3A (0.39) GSK3AGSK3BNOTUM
SCHEMBL20772377 0.69 PDE5A (0.40) GSK3AGSK3BPDE5A
SCHEMBL20772668 0.69 CHEK1 (0.42) PDE5ANOTUM
SCHEMBL27122590 0.69 KDM4E (0.44) GSK3AGSK3B
SCHEMBL17141130 0.69 PDE5A (0.40) GSK3AGSK3BPDE5A

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
WO-2019043635-A1 D-AMINO ACID OXIDASE ACTIVITY INHIBITING COMPOUNDS RICHTER GEDEON NYRT. (HU) 2019-03-07 WO claimed
WO-2019043635-A1 D-AMINO ACID OXIDASE ACTIVITY INHIBITING COMPOUNDS RICHTER GEDEON NYRT. (HU) 2019-03-07 WO disclosed