SCHEMBL14720276

SCHEMBL14720276

O=C1CC(=O)n2nc(N3C(=O)c4ccccc4C3=O)c(Cc3cccc4ccccc34)c2N1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
ALDH1A1 P00352 3/20 0.36
GLA P06280 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CMA1 P23946 2/20 0.36
NQO1 P15559 1/20 0.35
P2RX4 Q99571 3/20 0.35
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALPL P05186 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CA12 O43570 1/20 0.33

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
SCHEMBL15856085 0.84 MAPT (0.35) GAAALPLMEN1LMNAMAPT
SCHEMBL14720607 0.82 ALDH1A1 (0.39) ALDH1A1GLATSHRMAPK1CMA1
SCHEMBL14728242 0.68 NQO1 (0.38) POLBALDH1A1GLATSHRMAPK1
SCHEMBL14720133 0.63 PIK3CB (0.45)
SCHEMBL14720116 0.62 PIK3CB (0.40) POLBMEN1LMNAMAPTKMT2A
SCHEMBL1337353 0.59 CA12 (0.57) POLBALDH1A1KDM4EGAAHPGD
SCHEMBL5341408 0.59 MAPT (0.62) POLBALDH1A1P2RX4KDM4EHPGD
SCHEMBL1264765 0.58 POLB (0.54) POLBALDH1A1KDM4EGAAHPGD
SCHEMBL13516447 0.58 SMN1; SMN2 (0.43) POLBALDH1A1GLAKDM4EGAA
SCHEMBL3242823 0.57 MAPT (0.57) POLBALDH1A1TSHRKDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096605-B2 Pyrazolopyrimidine derivatives as PI3 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2015-08-04 US disclosed
US-20140187545-A1 Pyrazolopyrimidine Derivatives As PI3 Kinase Inhibitors GLAXOSMITHKLINE LLC (US) 2014-07-03 US disclosed
WO-2013028263-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS PI3 KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-02-28 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-20140187545-A1 Pyrazolopyrimidine Derivatives As PI3 Kinase Inhibitors PI4KB, PIK3CA, PI4K2B POLB 910/4885ALDH1A1 4458/4885GLA 4100/4885

“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.