SCHEMBL19251401

SCHEMBL19251401

CC(Nc1nc(F)nc2[nH]cnc12)C1=Nc2ccccc2SN1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 19/20 0.49
PIK3R1 P27986 15/20 0.49
PIK3CG P48736 6/20 0.38
PIK3CB P42338 5/20 0.38
PIK3CA P42336 3/20 0.38
PIK3C3 Q8NEB9 1/20 0.33

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
SCHEMBL19251388 0.90 PIK3R1 (0.47) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251396 0.86 PIK3CD (0.45) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251398 0.83 PIK3CD (0.48) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251420 0.79 PIK3R1 (0.76) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251404 0.78 PIK3CD (0.49) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251390 0.77 PIK3R1 (0.38) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251611 0.77 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19252623 0.77 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251406 0.77 PIK3CD (0.53) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251614 0.74 PIK3CD (0.47) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA

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-2017133655-A1 BENZOTHIAZINE AND BENZOTHIADIAZINE COMPOUNDS AND PREPARATION AND USE 浙江大学 2017-08-10 WO disclosed