SCHEMBL25037112

SCHEMBL25037112

CCc1c(N2CCNCC2)c(=O)n2nc(C3=CCOCC3)nc2n1CC(=O)Nc1cc(C(F)(F)F)c(Cl)cc1C

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.61
▸ PIK3CD O00329 1/20 0.33
▸ PIK3C2B O00750 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ GAA P10253 1/20 0.31
▸ WDR5 P61964 1/20 0.31

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
SCHEMBL30037645 1.00 WRN (0.61) WRNPIK3CDPIK3C2BPIK3CGGAA
SCHEMBL25035210 0.97 WRN (0.61) WRNPIK3CDPIK3C2BPIK3CGGAA
SCHEMBL30038429 0.94 WRN (0.59) WRNWDR5
SCHEMBL30984281 0.94 WRN (0.62) WRNPIK3CDPIK3C2BPIK3CGWDR5
SCHEMBL25036704 0.92 WRN (0.57) WRNPIK3CDPIK3C2BPIK3CGWDR5
SCHEMBL30038198 0.92 WRN (0.57) WRNPIK3CDPIK3C2BPIK3CGWDR5
SCHEMBL30038380 0.91 WRN (0.59) WRNWDR5
SCHEMBL25036830 0.90 WRN (0.57) WRN
SCHEMBL30984186 0.90 WRN (0.57) WRNPIK3CDPIK3C2BPIK3CGGAA
SCHEMBL30984208 0.90 WRN (0.59) WRNPIK3CDPIK3C2BPIK3CGWDR5

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-20230046859-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2023-02-16 — — 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-20230046859-A1 Bicyclic Compounds and their Uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 WRN 1829/4885PIK3CD 2890/4885PIK3C2B 1334/4885

“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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