SCHEMBL3783879

SCHEMBL3783879

CCNC(=N)c1c(-c2ccccn2)c([C@H](C)Nc2ncnc(N)c2C#N)nc2ccc(F)cc12

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 20/20 0.85
PIK3CG P48736 19/20 0.85
PIK3CB P42338 18/20 0.85
PIK3CA P42336 16/20 0.85
CYP2D6 P10635 1/20 0.68
CYP3A4 P08684 3/20 0.65

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
SCHEMBL2719559 1.00 PIK3CD (0.85) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2720174 0.92 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2720176 0.92 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL3784558 0.88 PIK3CD (0.87) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2718259 0.88 PIK3CD (0.87) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL3783883 0.87 PIK3CD (0.79) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL8480215 0.86 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL2717515 0.86 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL8482342 0.86 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6
SCHEMBL6122147 0.86 PIK3CD (1.00) PIK3CDPIK3CGPIK3CBPIK3CACYP2D6

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-9873704-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2018-01-23 US claimed
US-20160333017-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2016-11-17 US claimed
EP-2445900-B1 POLYCYCLIC DERIVATIVES OF PYRIDINE AND THEIR USE IN THE TREATMENT OF (INTER ALIA) RHEUMATOID ARTHRITIS AND SIMILAR DISEASES AMGEN INC (US) 2016-03-02 EP claimed
US-20100331306-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 US claimed
US-9873704-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2018-01-23 US disclosed
US-20160333017-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2016-11-17 US disclosed
EP-2445900-B1 POLYCYCLIC DERIVATIVES OF PYRIDINE AND THEIR USE IN THE TREATMENT OF (INTER ALIA) RHEUMATOID ARTHRITIS AND SIMILAR DISEASES AMGEN INC (US) 2016-03-02 EP disclosed
US-20100331306-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2010-12-30 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 (2 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-20100331306-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 15/4885PIK3CG 53/4885PIK3CB 35/4885
US-20160333017-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 PIK3CD 16/4885PIK3CG 54/4885PIK3CB 35/4885

“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.