SCHEMBL15718962

SCHEMBL15718962

CCc1nc2c(NC3CCN(C(=O)C4CC4)C3)ncnc2n1CC

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 20/20 0.74
▸ PIK3R1 P27986 20/20 0.74
▸ PIK3CA P42336 4/20 0.63
▸ PDE4A P27815 1/20 0.54
▸ PDE4B Q07343 1/20 0.54
▸ PDE4C Q08493 1/20 0.54
▸ PDE4D Q08499 1/20 0.54

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
SCHEMBL15731480 1.00 PIK3CD (0.74) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15719368 0.92 PIK3CD (0.71) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15719186 0.92 PIK3CD (0.70) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15731703 0.92 PIK3CD (0.70) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15731693 0.91 PIK3CD (0.69) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15719616 0.91 PIK3CD (0.69) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15720245 0.90 PIK3CD (0.60) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15719805 0.90 PIK3CD (0.68) PIK3CDPIK3R1PIK3CAPDE4APDE4B
SCHEMBL15731697 0.90 PIK3CD (0.68) PIK3CDPIK3R1PIK3CA
SCHEMBL15719560 0.90 PIK3CD (0.68) PIK3CDPIK3R1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938281-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta MERCK SHARP & DOHME CORP. (US) 2018-04-10 — — US claimed
US-20160207926-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2016-07-21 — — US claimed
EP-2920172-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA Merck Sharp & Dohme Corp. (US) 2015-09-23 — — EP claimed
CN-104918940-A Purine inhibitors of human phosphatidylinositol 3-kinase MERCK SHARP & DOHME 2015-09-16 — — CN claimed
WO-2014075393-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2014-05-22 — — WO claimed
US-9938281-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta MERCK SHARP & DOHME CORP. (US) 2018-04-10 — — US disclosed
US-20160207926-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2016-07-21 — — US disclosed
EP-2920172-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA Merck Sharp & Dohme Corp. (US) 2015-09-23 — — EP disclosed
CN-104918940-A Purine inhibitors of human phosphatidylinositol 3-kinase MERCK SHARP & DOHME 2015-09-16 — — CN disclosed
WO-2014075393-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME CORP. (US) 2014-05-22 — — 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-20160207926-A1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA PIK3CD, PIK3CA, PI4KA PIK3CD 1/4885PIK3R1 64/4885PIK3CA 2/4885

“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.

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