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SCHEMBL19787873

SCHEMBL19787873

C[C@H](Nc1ncnc2[nH]c(-c3cc(F)cc(-c4cc5c(Cl)cccc5nc4[C@@H](C)Nc4ncnc5[nH]cnc45)c3)nc12)c1nc2cccc(Cl)c2cc1-c1cccc(F)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 18/20 0.41
▸ MAP4K4 O95819 1/20 0.39
▸ AXL P30530 2/20 0.38
▸ MERTK Q12866 2/20 0.38
▸ PIK3CG P48736 3/20 0.36
▸ PIK3CB P42338 2/20 0.36
▸ PIK3R1 P27986 1/20 0.36
▸ PIK3CA P42336 1/20 0.36

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
SCHEMBL2717304 0.92 PIK3CD (0.45) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL3779917 0.92 PIK3CD (0.45) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4565628 0.92 PIK3CD (0.45) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL17928744 0.83 PIK3CD (0.40) PIK3CDPIK3CGPIK3CBPIK3R1PIK3CA
SCHEMBL4176480 0.79 MAP4K4 (0.46) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4185001 0.79 MAP4K4 (0.46) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4175910 0.79 MAP4K4 (0.46) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4182679 0.79 PIK3CD (0.49) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4178843 0.79 PIK3CD (0.49) PIK3CDMAP4K4AXLMERTKPIK3CG
SCHEMBL4167376 0.79 PIK3CD (0.49) PIK3CDMAP4K4AXLMERTKPIK3CG

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
US-9873704-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2018-01-23 — — US disclosed