SCHEMBL8093434

SCHEMBL8093434

Cc1csc(S(=O)(=O)C2(c3cc(N)nc(-c4ccc(NC(=O)NC(C)(C)CO)cc4)n3)CCC2)n1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 9/20 0.35
PIK3CA P42336 4/20 0.35
POLB P06746 2/20 0.34
MAPK1 P28482 1/20 0.33
JAK2 O60674 1/20 0.31
RAB9A P51151 1/20 0.30

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
SCHEMBL8096192 0.97 PIK3CD (0.36) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8085149 0.88 PIK3CA (0.39) PIK3CDPIK3CAMAPK1RAB9A
SCHEMBL8097960 0.86 KDM4E (0.38) PIK3CDPIK3CAPOLBJAK2RAB9A
SCHEMBL8097954 0.86 MAPK1 (0.33) PIK3CDPIK3CAPOLBMAPK1RAB9A
SCHEMBL8089738 0.85 PIK3CD (0.41) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8082658 0.85 PIK3CD (0.39) PIK3CDPIK3CAPOLB
SCHEMBL8091977 0.85 PIK3CD (0.35) PIK3CDPIK3CAPOLBRAB9A
SCHEMBL8090804 0.84 MTOR (0.37) PIK3CDPIK3CAPOLBRAB9A
SCHEMBL8093619 0.84 PIK3CD (0.41) PIK3CDPIK3CAPOLBMAPK1JAK2
SCHEMBL8089088 0.84 PIK3CA (0.40) PIK3CDPIK3CAMAPK1RAB9A

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-2009007748-A2 TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES ASTRAZENECA AB (SE) 2009-01-15 WO disclosed