SCHEMBL25035489

SCHEMBL25035489

Cc1ccc(CS(=O)(=O)Nc2ccc(-c3nc4cnc(N)nc4n(C(C)C)c3=O)cc2F)c(C#N)c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 10/20 0.70
BRAF P15056 2/20 0.34
MTOR P42345 4/20 0.34
PGR P06401 1/20 0.33
PIK3CD O00329 2/20 0.32
ABL1 P00519 1/20 0.32
EGFR P00533 1/20 0.32
HCK P08631 1/20 0.32
SRC P12931 1/20 0.32
KDR P35968 1/20 0.32
PIK3CA P42336 1/20 0.32
PIK3CB P42338 1/20 0.32
PIK3CG P48736 1/20 0.32
EPHB4 P54760 1/20 0.32
PRKDC P78527 1/20 0.32
RORC P51449 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
SCHEMBL25035545 0.91 ERN1 (0.59) ERN1BRAFPGRPIK3CD
SCHEMBL25035627 0.89 ERN1 (0.58) ERN1BRAFMTORPIK3CGRORC
SCHEMBL22200583 0.86 ERN1 (0.54) ERN1MTORPIK3CDABL1EGFR
SCHEMBL25035430 0.86 ERN1 (0.69) ERN1BRAFPGRPIK3CGRORC
SCHEMBL29356015 0.83 ERN1 (1.00) ERN1BRAF
SCHEMBL22190633 0.83 ERN1 (1.00) ERN1BRAF
SCHEMBL25035335 0.83 ERN1 (0.58) ERN1BRAFPIK3CG
SCHEMBL25035369 0.83 ERN1 (0.57) ERN1BRAF
SCHEMBL25035356 0.82 ERN1 (0.49) ERN1PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL25035427 0.82 BRAF (0.51) ERN1BRAFRORC

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 3167/4885BRAF 563/4885MTOR 487/4885

“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.