SCHEMBL25035590

SCHEMBL25035590

CC(C)n1c(=O)c(-c2ccc(NS(=O)(=O)C3CCC3)c(F)c2)nc2cnc(N)nc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 10/20 0.47
ALOX5AP P20292 2/20 0.44
FEN1 P39748 2/20 0.44
KIT P10721 1/20 0.41
CTPS1 P17812 2/20 0.38
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
MTOR P42345 2/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ELANE P08246 1/20 0.35

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
SCHEMBL25034158 0.93 ERN1 (0.46) ERN1ALOX5APFEN1KITCTPS1
SCHEMBL25035373 0.91 ERN1 (0.46) ERN1ALOX5APFEN1KITCYP1A2
SCHEMBL25035576 0.90 ERN1 (0.45) ERN1ALOX5APFEN1KITCYP1A2
SCHEMBL25035637 0.88 ERN1 (0.51) ERN1CYP1A2CYP3A4MTORUSP2
SCHEMBL25035622 0.87 ERN1 (0.46) ERN1ALOX5APFEN1KITCYP1A2
SCHEMBL25035694 0.86 ERN1 (0.51) ERN1KITCYP1A2CYP3A4MTOR
SCHEMBL25034244 0.86 ERN1 (0.46) ERN1ALOX5APFEN1CYP1A2CYP3A4
SCHEMBL25035642 0.85 ERN1 (0.50) ERN1KITCYP1A2CYP3A4MTOR
SCHEMBL25035480 0.85 ALOX5AP (0.48) ERN1ALOX5APFEN1KITCYP1A2
SCHEMBL25035485 0.84 ERN1 (0.48) ERN1ALOX5APFEN1KITCYP1A2

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 3167/4885ALOX5AP 1186/4885FEN1 50/4885

“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.