SCHEMBL470240

SCHEMBL470240

c1cc(-c2cc(-c3ncc(CN4CCNCC4)o3)c3cn[nH]c3c2)c2cc[nH]c2c1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 13/20 0.80
PIK3CB P42338 11/20 0.80
PIK3CG P48736 9/20 0.80
PIK3CA P42336 9/20 0.80
PIM1 P11309 3/20 0.44
GSK3B P49841 2/20 0.44
PIK3R2 O00459 1/20 0.41
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
MAP3K11 Q16584 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR6 P50406 1/20 0.35
HPGDS O60760 1/20 0.35
METAP2 P50579 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
SCHEMBL470233 0.91 PIK3CD (0.80) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
SCHEMBL23140774 0.90 PIK3CD (0.80) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL29356978 0.89 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL109919 0.89 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL29493085 0.89 PIK3CD (1.00) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL659144 0.88 PIK3CD (0.98) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL111259 0.88 PIK3CD (0.98) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
Nemiralisib SCHEMBL18281137 0.87 PIK3CD (0.97) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
SCHEMBL470235 0.85 PIK3CD (0.73) PIK3CDPIK3CBPIK3CGPIK3CAPIM1
SCHEMBL16927091 0.85 PIK3CD (0.73) PIK3CDPIK3CBPIK3CGPIK3CAPIM1

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 70 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 claimed
EP-3260453-A1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS Glaxo Group Limited (GB) 2017-12-27 EP claimed
EP-2613781-B1 INDAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF INFLUENZA VIRUS INFECTION GLAXOSMITHKLINE IP DEV LTD (GB) 2016-08-24 EP claimed
US-8586583-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-11-19 US claimed
US-20130165433-A1 Novel Use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-06-27 US claimed
US-20130096117-A1 Novel Compounds GLAXO GROUP LIMITED (GB) 2013-04-18 US claimed
US-20120046286-A1 Novel Compounds HAMBLIN JULIE NICOLE (GB) 2012-02-23 US claimed
EP-3260453-B1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LTD (GB) 2021-03-31 EP disclosed
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-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-20200206237-A1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2020-07-02 US disclosed
WO-2010125082-A1 OXAZOLE SUBSTITUTED INDAZOLES AS PI3-KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2010-11-04 WO disclosed
US-20100280045-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-11-04 US disclosed
US-20100280029-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-11-04 US disclosed
US-20100280029-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-11-04 US 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
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 (7 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-10946025-B2 Compounds PIK3CA, PIK3CD, PIK3C3 PIK3CD 2/4885PIK3CB 5/4885PIK3CG 7/4885
US-20100280045-A1 NOVEL COMPOUNDS PLK3, PLK1, PLK2 PIK3CD 73/4885PIK3CB 51/4885PIK3CG 93/4885
US-20100280029-A1 NOVEL COMPOUNDS PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CB 4/4885PIK3CG 10/4885
US-20130165433-A1 Novel Use HAVCR2, MAVS, ENTPD5 PIK3CD 2938/4885PIK3CB 1706/4885PIK3CG 2718/4885
US-20120046286-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CB 4/4885PIK3CG 10/4885
US-20130096117-A1 Novel Compounds PIK3CD, PIK3CA, PIK3C2B PIK3CD 1/4885PIK3CB 4/4885PIK3CG 10/4885
US-20200206237-A1 NOVEL COMPOUNDS PIK3CA, PIK3CD, PIK3C2B PIK3CD 2/4885PIK3CB 4/4885PIK3CG 11/4885

“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.