SCHEMBL19251398

SCHEMBL19251398

CC(Nc1ncnc2[nH]cnc12)C1=Nc2ccccc2SN1c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 16/20 0.48
PIK3R1 P27986 12/20 0.48
PIK3CG P48736 4/20 0.37
PIK3CB P42338 3/20 0.37
PIK3CA P42336 2/20 0.37
EGFR P00533 3/20 0.35
PIK3C3 Q8NEB9 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL19251396 0.92 PIK3CD (0.45) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251405 0.88 PIK3CD (0.39) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251404 0.85 PIK3CD (0.49) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251390 0.84 PIK3R1 (0.38) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251401 0.83 PIK3CD (0.49) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251611 0.83 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19252623 0.83 PIK3CD (0.44) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19252622 0.80 PIK3CD (0.38) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19251612 0.80 PIK3CD (0.38) PIK3CDPIK3R1PIK3CGPIK3CBPIK3CA
SCHEMBL19252621 0.79 PIK3R1 (0.49) 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