SCHEMBL17397202

SCHEMBL17397202

NCCc1cc2ccc(F)cn2c(=O)c1-c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.40
MAOB P27338 1/20 0.37
PIK3CD O00329 7/20 0.35
PIK3CB P42338 2/20 0.35
TAAR1 Q96RJ0 1/20 0.34
HTR6 P50406 1/20 0.34
HTR2A P28223 2/20 0.32
MPO P05164 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
DPP4 P27487 1/20 0.32
HTR1A P08908 1/20 0.31
KMT2A Q03164 1/20 0.31
APP P05067 1/20 0.31
CYP3A4 P08684 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 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
SCHEMBL17397174 0.92 PIK3CD (0.42) PIK3CAPIK3CDPIK3CBTAAR1HTR6
SCHEMBL17397176 0.91 PIK3CD (0.41) PIK3CAMAOBPIK3CDPIK3CBTAAR1
SCHEMBL17397271 0.87 TAAR1 (0.42) PIK3CAPIK3CDPIK3CBTAAR1
SCHEMBL17397294 0.85 PIK3CD (0.46) PIK3CAPIK3CDPIK3CBTAAR1
SCHEMBL18989093 0.81 HTR2A (0.33) PIK3CAPIK3CDPIK3CBTAAR1HTR6
SCHEMBL17397122 0.80 TAAR1 (0.37) PIK3CAPIK3CDPIK3CBTAAR1MPO
SCHEMBL17397287 0.80 PIM1 (0.41)
SCHEMBL17397173 0.79 PIK3CD (0.41) PIK3CAPIK3CDPIK3CB
SCHEMBL18989250 0.78 MAOB (0.37) MAOBPIK3CDTAAR1HTR6HTR2A
SCHEMBL18989286 0.75 PIK3CD (0.40) PIK3CAPIK3CDPIK3CB

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