SCHEMBL2717090

SCHEMBL2717090

CCN(C(=O)OC(C)(C)C)c1nc2ccc(F)cc2c(Cl)c1-c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.41
PIK3CB P42338 7/20 0.41
PIK3CG P48736 7/20 0.41
PIK3CA P42336 6/20 0.41
GRM1 Q13255 2/20 0.39
RORC P51449 1/20 0.38
PLA2G2A P14555 2/20 0.35
AAK1 Q2M2I8 1/20 0.35
DHODH Q02127 2/20 0.34
PRNP P04156 1/20 0.34

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
SCHEMBL6128775 0.92 GRM1 (0.41) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL2717294 0.89 DHODH (0.40) RORCPLA2G2ADHODHPRNP
SCHEMBL2719961 0.89 PIK3CD (0.45) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL2716749 0.88 PIK3CD (0.43) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL2716874 0.86 PIK3CD (0.48) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL2717639 0.85 PIK3CD (0.51) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL6121707 0.85 PIK3CD (0.44) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL6122094 0.84 PIK3CD (0.42) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL2718639 0.83 PIK3CD (0.44) PIK3CDPIK3CBPIK3CGPIK3CAGRM1
SCHEMBL6123048 0.83 PIK3CD (0.35) PIK3CDPIK3CBPIK3CGPIK3CAGRM1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445900-A2 POLYCYCLIC DERIVATIVES OF PYRIDINE AND THEIR USE IN THE TREATMENT OF (INTER ALIA) RHEUMATOID ARTHRITIS AND SIMILAR DISEASES Amgen, Inc (US) 2012-05-02 EP disclosed
WO-2010151740-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-29 WO disclosed