SCHEMBL25035559

SCHEMBL25035559

COc1nc(NS(=O)(=O)c2ccccc2Cl)ccc1-c1cc2cnc(N)nc2n(C(C)C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 4/20 0.43
PIK3CA P42336 4/20 0.43
PIK3CD O00329 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
EGFR P00533 1/20 0.40
FGFR1 P11362 1/20 0.40
SRC P12931 1/20 0.40
FGFR2 P21802 1/20 0.40
FGFR4 P22455 1/20 0.40
FGFR3 P22607 1/20 0.40
PKM P14618 1/20 0.38
MTOR P42345 3/20 0.38
TP53 P04637 1/20 0.36
MDM2 Q00987 1/20 0.36

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
SCHEMBL25035541 0.89 EGFR (0.42) CCR4PIK3CAEGFRFGFR1SRC
SCHEMBL25035456 0.87 PIK3CA (0.45) CCR4PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL25034113 0.86 MTOR (0.42) CCR4PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL29352945 0.82 ERN1 (0.51) CCR4FGFR1
SCHEMBL22190978 0.82 ERN1 (0.51) CCR4FGFR1
SCHEMBL22190981 0.82 ERN1 (0.51) CCR4FGFR1
SCHEMBL25035531 0.79 FEN1 (0.40) PIK3CAMTOR
SCHEMBL25035654 0.78 PIK3CA (0.36) PIK3CAEGFRFGFR1SRCFGFR2
SCHEMBL25035336 0.77 PKM (0.41) CCR4PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL25035635 0.76 BTK (0.38) PIK3CAPIK3CDPIK3CBPIK3CGEGFR

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 CCR4 2732/4885PIK3CA 211/4885PIK3CD 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.