SCHEMBL20628540

SCHEMBL20628540

Cc1ccc2c(c1)C(=O)N(C)c1cnc(Nc3ccccc3)nc1N2C

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 15/20 0.74
▸ PIK3CG P48736 15/20 0.74
▸ PIK3C2G O75747 14/20 0.74
▸ AURKA O14965 12/20 0.74
▸ AURKB Q96GD4 12/20 0.74
▸ NUAK1 O60285 2/20 0.66
▸ BRD4 O60885 5/20 0.65
▸ LRRK2 Q5S007 4/20 0.65
▸ PLK4 O00444 2/20 0.65
▸ AURKC Q9UQB9 2/20 0.65
▸ PIK3CA P42336 4/20 0.63
▸ PIK3CB P42338 3/20 0.63
▸ DCLK1 O15075 3/20 0.61
▸ MAPK7 Q13164 1/20 0.60

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
SCHEMBL17519893 0.87 DCLK1 (0.78) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL21937775 0.86 PIK3CD (0.84) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL24743571 0.86 PIK3CD (0.73) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL16065758 0.86 PIK3CG (1.00) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL19457412 0.85 PIK3CD (1.00) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL24742744 0.84 PIK3CD (0.70) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL20628529 0.84 PIK3CD (0.68) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL24742679 0.82 PIK3CD (0.66) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL24742671 0.82 PIK3CD (0.65) PIK3CDPIK3CGPIK3C2GAURKAAURKB
SCHEMBL19457382 0.81 PIK3CD (1.00) PIK3CDPIK3CGPIK3C2GAURKAAURKB

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-3424929-A1 PYRIMIDINE SEVEN-MEMBERED-RING COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USES THEREOF Anhui New Star Pharmaceutical Development Co., Ltd (CN) 2019-01-09 — — EP disclosed
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