SCHEMBL4250160

SCHEMBL4250160

O=C1NC(=O)C(=Cc2ccc3ncc(-c4ccncc4)n3c2)S1.[NaH]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 5/20 0.58
MAOA P21397 3/20 0.58
GSK3B P49841 2/20 0.58
PIK3CG P48736 3/20 0.54
MTOR P42345 5/20 0.50
PIM1 P11309 5/20 0.50
PIK3CD O00329 2/20 0.50
CSNK2A2 P19784 2/20 0.50
PIK3CA P42336 2/20 0.50
PIK3CB P42338 2/20 0.50
CLK1 P49759 2/20 0.50
DYRK1A Q13627 2/20 0.50
GAK O14976 1/20 0.50
RPS6KA4 O75676 1/20 0.50
STK10 O94804 1/20 0.50
MAP2K2 P36507 1/20 0.50
CSNK1D P48730 1/20 0.50
CLK2 P49760 1/20 0.50
CSNK1G2 P78368 1/20 0.50
MAP2K1 Q02750 1/20 0.50

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
SCHEMBL4250156 1.00 CISD1 (0.58) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL13745894 0.99 CISD1 (0.59) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL4258413 0.87 GSK3B (0.59) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL4258410 0.87 GSK3B (0.59) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL13745378 0.81 PIK3CG (0.53) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL14852239 0.80 PIM1 (0.72) PIK3CGMTORPIM1NPC1RAB9A
SCHEMBL4251796 0.78 PIK3CG (0.57) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL4253633 0.78 PIK3CG (0.57) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL4254853 0.78 RAB9A (0.59) CISD1MAOAGSK3BPIK3CGMTOR
SCHEMBL4253630 0.78 PIK3CG (0.57) CISD1MAOAGSK3BPIK3CGMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-08-27 US claimed
US-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-08-27 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 (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-20090215818-A1 THIOZOLIDINEDIONE DERIVATIVES AS PI3 KINASE INHIBITORS PIK3CD, PI4KA, PIP4K2A CISD1 3668/4885MAOA 3932/4885GSK3B 398/4885

“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.