SCHEMBL21589417

SCHEMBL21589417

CSc1ccc(-c2csc(NC(=O)CSc3nc4nccnc4c(=O)n3CCc3ccccc3)n2)cc1

nearest known ligand 0.88

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3C2A O00443 20/20 0.88
PIK3C2B O00750 3/20 0.77
PIK3C2G O75747 1/20 0.69

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
SCHEMBL21586304 0.94 PIK3C2A (1.00) PIK3C2APIK3C2BPIK3C2G
SCHEMBL30002973 0.94 PIK3C2A (1.00) PIK3C2APIK3C2BPIK3C2G
SCHEMBL21586323 0.92 PIK3C2A (0.89) PIK3C2APIK3C2BPIK3C2G
SCHEMBL30003202 0.92 PIK3C2A (0.89) PIK3C2APIK3C2BPIK3C2G
SCHEMBL30002620 0.91 PIK3C2A (0.85) PIK3C2APIK3C2BPIK3C2G
SCHEMBL21586339 0.91 PIK3C2A (0.85) PIK3C2APIK3C2BPIK3C2G
SCHEMBL21586342 0.90 PIK3C2A (0.84) PIK3C2APIK3C2BPIK3C2G
SCHEMBL30003026 0.90 PIK3C2A (0.84) PIK3C2APIK3C2BPIK3C2G
SCHEMBL21586295 0.90 PIK3C2A (1.00) PIK3C2APIK3C2BPIK3C2G
SCHEMBL30003030 0.90 PIK3C2A (1.00) PIK3C2APIK3C2BPIK3C2G

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-2019234237-A1 HETEROCYCLIC COMPOUNDS AS CLASS II PHOSPHOINOSITIDE 3-KINASE INHIBITORS FORSCHUNGSVERBUND BERLIN E.V. (DE) 2019-12-12 WO disclosed