SCHEMBL25035440

SCHEMBL25035440

CC(C)n1c(=O)c(-c2ccc(NS(=O)(=O)c3ccccc3Cl)c(F)c2)nc2cnc(N)nc21

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 0.48
PIK3CG P48736 7/20 0.45
PIK3CD O00329 5/20 0.45
PIK3CA P42336 5/20 0.45
PIK3CB P42338 5/20 0.45
KIT P10721 2/20 0.44
SGK1 O00141 4/20 0.42
PI4KA P42356 2/20 0.39

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
SCHEMBL25035356 0.89 ERN1 (0.49) ERN1PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL25035568 0.88 ERN1 (0.45) ERN1PIK3CGKITPI4KA
SCHEMBL25035544 0.85 MTOR (0.42) PIK3CGPIK3CDPIK3CAPIK3CBSGK1
SCHEMBL29356052 0.85 ERN1 (0.52) ERN1
SCHEMBL22190906 0.85 ERN1 (0.52) ERN1
SCHEMBL22190907 0.85 ERN1 (0.52) ERN1
SCHEMBL25035486 0.84 ERN1 (0.43) ERN1PIK3CGPIK3CAKITPI4KA
SCHEMBL25035485 0.83 ERN1 (0.48) ERN1PIK3CGKITPI4KA
SCHEMBL25035369 0.83 ERN1 (0.57) ERN1
SCHEMBL22200350 0.83 USP2 (0.38) ERN1KIT

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-20230047209-A1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AND METHODS OF USE PARAZA PHARMA, INC. (CA) 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-20230047209-A1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AND METHODS OF USE TYMP, TYMS, DPYD ERN1 3167/4885PIK3CG 971/4885PIK3CD 906/4885

“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.