SCHEMBL18034005

SCHEMBL18034005

C[C@@H](O)c1nn(Cc2cc3ccccc3nc2N2CCN(C)CC2)c2ncnc(N)c12

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.75
PIK3C2B O00750 10/20 0.69
PIK3CG P48736 7/20 0.63
PIK3CA P42336 2/20 0.63
PIK3CB P42338 2/20 0.63

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
SCHEMBL685506 0.93 PIK3CD (0.75) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL680957 0.86 PIK3CD (0.88) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL681698 0.86 PIK3CD (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL681993 0.82 PIK3C2B (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL681061 0.80 PIK3C2B (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL681700 0.79 PIK3CD (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL680974 0.78 PIK3CG (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL15892695 0.78 PIK3C2B (0.80) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL680909 0.77 PIK3CD (0.84) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB
SCHEMBL681716 0.77 PIK3C2B (1.00) PIK3CDPIK3C2BPIK3CGPIK3CAPIK3CB

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-2346508-B1 HETEROCYCLIC KINASE INHIBITORS INTELLIKINE LLC (US) 2016-08-24 EP disclosed