SCHEMBL1325630

SCHEMBL1325630

COC(=O)c1cc(Cl)c2cncn2c1-c1cccc(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 6/20 0.43
CSNK1D P48730 2/20 0.41
RPS6KB1 P23443 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
DYRK1A Q13627 1/20 0.41
NTRK2 Q16620 1/20 0.41
AURKB Q96GD4 1/20 0.41
NR4A2 P43354 2/20 0.38
MAPK14 Q16539 1/20 0.38
GRIN2B Q13224 1/20 0.37
SCN9A Q15858 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 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
SCHEMBL1325329 0.89 RPS6KB1 (0.43) LCKCSNK1DRPS6KB1GSK3AGSK3B
SCHEMBL1325671 0.88 GRIN2B (0.39) LCKGRIN2BSCN9APTGS2
SCHEMBL18817207 0.88 LCK (0.44) LCKNR4A2KDM4EALDH1A1HPGD
SCHEMBL1325539 0.88 DCLRE1B (0.40) LCKCSNK1DGSK3AGSK3BDYRK1A
SCHEMBL1324749 0.85 TRPM8 (0.44) LCKCSNK1DRPS6KB1GSK3AGSK3B
SCHEMBL1324770 0.85 TRPM8 (0.40) LCKCSNK1DGRIN2BSCN9APTGS2
SCHEMBL18816981 0.84 NR4A2 (0.51) LCKNR4A2KDM4EALDH1A1HPGD
SCHEMBL1324537 0.80 MAPK14 (0.41) CSNK1DRPS6KB1GSK3AGSK3BDYRK1A
SCHEMBL18816898 0.80 CSNK1D (0.39) CSNK1DRPS6KB1GSK3AGSK3BDYRK1A
SCHEMBL1325638 0.78 MAPK14 (0.39) CSNK1DRPS6KB1GSK3AGSK3BDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9193721-B2 Fused derivatives as PI3Kδ inhibitors INCYTE HOLDINGS CORPORATION (US) 2015-11-24 US disclosed
US-9193721-B2 Fused derivatives as PI3Kδ inhibitors INCYTE HOLDINGS CORPORATION (US) 2015-11-24 US disclosed
US-9193721-B2 Fused derivatives as PI3Kδ inhibitors INCYTE HOLDINGS CORPORATION (US) 2015-11-24 US disclosed
EP-2558463-A1 FUSED DERIVATIVES AS I3 INHIBITORS Incyte Corporation (US) 2013-02-20 EP disclosed
US-20110281884-A1 FUSED DERIVATIVES AS PI3KDELTA INHIBITORS INCYTE CORPORATION 2011-11-17 US disclosed
US-20110281884-A1 FUSED DERIVATIVES AS PI3KDELTA INHIBITORS INCYTE CORPORATION 2011-11-17 US disclosed
WO-2011130342-A1 FUSED DERIVATIVES AS ΡI3Κδ INHIBITORS INCYTE CORPORATION (US) 2011-10-20 WO disclosed
WO-2011130342-A1 FUSED DERIVATIVES AS ΡI3Κδ INHIBITORS INCYTE CORPORATION (US) 2011-10-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110281884-A1 FUSED DERIVATIVES AS PI3KDELTA INHIBITORS PIK3CD, PIK3CA, PIK3CB LCK 215/4885CSNK1D 685/4885RPS6KB1 150/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.