SCHEMBL29390907

SCHEMBL29390907

Cc1cccc(-c2nn(C(C)C)c3ncnc(N)c23)c1

nearest known ligand 0.98

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 20/20 0.98
▸ ABL1 P00519 17/20 0.76
▸ PIK3CD O00329 14/20 0.76
▸ PIK3CA P42336 14/20 0.76
▸ PIK3CG P48736 14/20 0.76
▸ PRKDC P78527 14/20 0.76
▸ EGFR P00533 13/20 0.76
▸ HCK P08631 13/20 0.76
▸ KDR P35968 13/20 0.76
▸ MTOR P42345 13/20 0.76
▸ EPHB4 P54760 13/20 0.76
▸ PIK3CB P42338 12/20 0.76
▸ PI4KB Q9UBF8 11/20 0.76

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
SCHEMBL14574629 1.00 SRC (0.98) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL7508684 0.89 SRC (0.78) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL14574603 0.88 SRC (0.76) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL409057 0.86 SRC (1.00) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL14574624 0.86 SRC (0.74) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL29390196 0.86 SRC (1.00) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL12437092 0.86 SRC (1.00) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL3630418 0.85 SRC (0.76) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL18196381 0.85 SRC (0.80) SRCABL1PIK3CDPIK3CAPIK3CG
SCHEMBL29388059 0.84 SRC (0.71) SRCABL1PIK3CDPIK3CAPIK3CG

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-11247972-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis, and other apicomplexan protozoan related diseases UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2022-02-15 — — 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-11247972-B2 Compositions and methods for treating toxoplasmosis, cryptosporidiosis, and other apicomplexan protozoan related diseases PNCK, TXK, CILK1 SRC 132/4885ABL1 1181/4885PIK3CD 167/4885

“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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