SCHEMBL17397111

SCHEMBL17397111

Cc1cccc2cc(CCN)c(-c3cc(F)cc(F)c3)c(=O)n12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 6/20 0.35
TAAR1 Q96RJ0 3/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CA P42336 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL17397136 0.87 PIK3CD (0.37) PIK3CDTAAR1PIK3CBPIK3CA
SCHEMBL17397079 0.86 PIK3CD (0.42) PIK3CDTAAR1PIK3CBPIK3CA
SCHEMBL17397072 0.79 TAAR1 (0.40) PIK3CDTAAR1KDM4E
SCHEMBL17397110 0.77 PIK3CD (0.43) PIK3CDPIK3CBPIK3CA
SCHEMBL17397228 0.75 PIK3CD (0.55) PIK3CDPIK3CBPIK3CA
SCHEMBL17397176 0.73 PIK3CD (0.41) PIK3CDTAAR1PIK3CBPIK3CA
SCHEMBL17397164 0.73 PIK3CD (0.43) PIK3CDPIK3CBPIK3CA
SCHEMBL17397294 0.71 PIK3CD (0.46) PIK3CDTAAR1PIK3CBPIK3CA
SCHEMBL17397082 0.71 PIK3CD (0.42) PIK3CDPIK3CBPIK3CAKDM4E
SCHEMBL17397141 0.69 PIK3CD (0.52) PIK3CDPIK3CBPIK3CA

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-3164400-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS Lupin Limited (IN) 2017-05-10 EP disclosed
WO-2016001855-A1 QUINOLIZINONE DERIVATIVES AS PI3K INHIBITORS LUPIN LIMITED (IN) 2016-01-07 WO disclosed