SCHEMBL20458971

SCHEMBL20458971

Cc1cccc2cc(CNC(=O)c3nccnc3N)c(N(C)CCN(C)C(=O)CN/C=C\C=N)nc12

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.78

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
SCHEMBL788439 0.88 PIK3CD (1.00) PIK3CD
SCHEMBL20458991 0.88 PIK3CD (0.77) PIK3CD
SCHEMBL20458928 0.88 PIK3CD (0.79) PIK3CD
SCHEMBL788354 0.86 PIK3CD (1.00) PIK3CD
SCHEMBL788897 0.85 PIK3CD (1.00) PIK3CD
SCHEMBL10117455 0.85 PIK3CD (0.89) PIK3CD
SCHEMBL19219105 0.84 PIK3CD (0.83) PIK3CD
SCHEMBL20458941 0.84 PIK3CD (0.79) PIK3CD
SCHEMBL788306 0.84 PIK3CD (0.86) PIK3CD
SCHEMBL20458956 0.83 PIK3CD (0.91) PIK3CD

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-2616442-B1 INHIBITORS OF PI3K-DELTA AND METHODS OF THEIR USE AND MANUFACTURE EXELIXIS INC (US) 2018-08-08 EP disclosed