SCHEMBL17705181

SCHEMBL17705181

Cc1nc2ccc(-c3nn(Cc4cc5ccccc5c(=O)n4-c4ccccc4C)c4ncnc(N)c34)cc2s1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 12/20 0.59
▸ PIK3CG P48736 8/20 0.56
▸ PIK3CA P42336 4/20 0.54
▸ PIK3CB P42338 4/20 0.54
▸ ABL1 P00519 1/20 0.54
▸ SRC P12931 1/20 0.54
▸ MTOR P42345 1/20 0.54
▸ PRKDC P78527 1/20 0.54
▸ PIK3C2B O00750 4/20 0.51

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
SCHEMBL9924629 0.93 PIK3CD (0.68) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9924634 0.89 PIK3CG (0.63) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9884210 0.87 PIK3CD (0.68) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9884115 0.85 PIK3CD (0.73) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL18708609 0.84 PIK3CD (0.64) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9884116 0.84 PIK3CD (0.64) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9884123 0.84 PIK3CD (0.68) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL20725920 0.84 PIK3CD (0.74) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL18708811 0.82 PIK3CD (0.62) PIK3CDPIK3CGPIK3CAPIK3CBABL1
SCHEMBL9884234 0.82 PIK3CD (0.63) PIK3CDPIK3CGPIK3CAPIK3CBABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160113932-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS, INC. (US) 2016-04-28 — — 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-20160113932-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS PIK3CA, PIK3CG, PIK3CD PIK3CD 3/4885PIK3CG 2/4885PIK3CA 1/4885

“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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