SCHEMBL175242

SCHEMBL175242

O=C(On1ncc2c(-c3ncc(CN4CCOCC4)o3)cc(-c3cccc4[nH]ccc34)cc21)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 15/20 0.52
PIK3CA P42336 13/20 0.52
PIK3CB P42338 11/20 0.52
PIK3CG P48736 11/20 0.52
ATR Q13535 3/20 0.35
MTOR P42345 2/20 0.35
CHEK1 O14757 1/20 0.35
PRKDC P78527 1/20 0.34
HPGDS O60760 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
Trifluoroacetic Acid SCHEMBL175243 0.83 PIK3CD (0.69) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL20212531 0.80 PIK3CD (0.64) PIK3CDPIK3CAPIK3CBPIK3CGMTOR
SCHEMBL470233 0.79 PIK3CD (0.80) PIK3CDPIK3CAPIK3CBPIK3CGATR
SCHEMBL15051784 0.73 PIK3CD (0.63) PIK3CDPIK3CAPIK3CBPIK3CGATR
SCHEMBL470240 0.71 PIK3CD (0.80) PIK3CDPIK3CAPIK3CBPIK3CGHPGDS
SCHEMBL17255824 0.70 PIK3CD (0.88) PIK3CDPIK3CAPIK3CBPIK3CGHPGDS
SCHEMBL470203 0.70 PIK3CD (0.67) PIK3CDPIK3CAPIK3CBPIK3CGATR
Hydrochloric Acid SCHEMBL17255819 0.70 PIK3CD (0.87) PIK3CDPIK3CAPIK3CBPIK3CGHPGDS
SCHEMBL23140774 0.70 PIK3CD (0.80) PIK3CDPIK3CAPIK3CBPIK3CGMTOR
Nemiralisib SCHEMBL18281137 0.69 PIK3CD (0.97) PIK3CDPIK3CAPIK3CBPIK3CGHPGDS

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260453-B1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LTD (GB) 2021-03-31 EP disclosed
US-10946025-B2 Compounds GLAXO GROUP LIMITED (GB) 2021-03-16 US disclosed
US-20200206237-A1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2020-07-02 US disclosed
US-10624898-B2 Compounds GLAXO GROUP LIMITED (GB) 2020-04-21 US disclosed
US-20190328744-A1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2019-10-31 US disclosed
US-10383879-B2 Compounds GLAXO GROUP LIMITED (GB) 2019-08-20 US disclosed
US-20190175608-A1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2019-06-13 US disclosed
US-20180325911-A1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2018-11-15 US disclosed
EP-3260453-A1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS Glaxo Group Limited (GB) 2017-12-27 EP disclosed
EP-2899191-B1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LTD (GB) 2017-08-09 EP disclosed
US-8580797-B2 Compounds Glaxo Smith Kline Intellectual Property Development Limited (GB) 2013-11-12 US disclosed
US-8575162-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-11-05 US disclosed
US-20130131080-A1 Novel Compounds GLAXO GROUP LIMITED (GB) 2013-05-23 US disclosed
US-20130096117-A1 Novel Compounds GLAXO GROUP LIMITED (GB) 2013-04-18 US disclosed
US-20130029985-A1 Novel Compounds GLAXO GROUP LIMITED (GB) 2013-01-31 US disclosed
EP-2424864-A1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS Glaxo Group Limited (GB) 2012-03-07 EP disclosed
US-20120046286-A1 Novel Compounds HAMBLIN JULIE NICOLE (GB) 2012-02-23 US disclosed
WO-2010125082-A1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO disclosed
US-20100280029-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-11-04 US disclosed
US-20100280045-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-11-04 US 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 (13 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-20130029985-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CA 2/4885PIK3CB 4/4885
US-20130131080-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CA 2/4885PIK3CB 4/4885
US-10624898-B2 Compounds PIK3CA, PIK3CD, PIK3C3 PIK3CD 2/4885PIK3CA 1/4885PIK3CB 5/4885
US-10383879-B2 Compounds PIK3CA, PIK3CD, PIK3C3 PIK3CD 2/4885PIK3CA 1/4885PIK3CB 5/4885
US-10946025-B2 Compounds PIK3CA, PIK3CD, PIK3C3 PIK3CD 2/4885PIK3CA 1/4885PIK3CB 5/4885
US-20190328744-A1 NOVEL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B PIK3CD 2/4885PIK3CA 1/4885PIK3CB 4/4885
US-20100280045-A1 NOVEL COMPOUNDS PLK3, PLK1, PLK2 PIK3CD 73/4885PIK3CA 70/4885PIK3CB 51/4885
US-20180325911-A1 NOVEL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B PIK3CD 2/4885PIK3CA 1/4885PIK3CB 4/4885
US-20190175608-A1 NOVEL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B PIK3CD 2/4885PIK3CA 1/4885PIK3CB 4/4885
US-20100280029-A1 NOVEL COMPOUNDS PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CA 2/4885PIK3CB 4/4885
US-20120046286-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CA 2/4885PIK3CB 4/4885
US-20130096117-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CA 2/4885PIK3CB 4/4885
US-20200206237-A1 NOVEL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B PIK3CD 2/4885PIK3CA 1/4885PIK3CB 4/4885

“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.