SCHEMBL25035471

SCHEMBL25035471

Cc1nc(NS(=O)(=O)c2ccc(F)cc2)ccc1-c1cc2cnc(N)nc2n(C(C)C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.40
PIK3CA P42336 9/20 0.38
MTOR P42345 4/20 0.38
ERN1 O75460 1/20 0.38
HSD11B1 P28845 2/20 0.37
BRAF P15056 1/20 0.37
RORC P51449 1/20 0.36
BRD4 O60885 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
KMO O15229 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
SCHEMBL25035531 0.86 FEN1 (0.40) BTKPIK3CAMTORBRAF
SCHEMBL22200738 0.85 BTK (0.40) BTKPIK3CAMTORERN1BRAF
SCHEMBL25035635 0.85 BTK (0.38) BTKPIK3CAMTORERN1BRAF
SCHEMBL25034212 0.84 RXFP1 (0.41) PIK3CAMTORHSD11B1
SCHEMBL25035541 0.83 EGFR (0.42) PIK3CAMTOR
SCHEMBL25035654 0.81 PIK3CA (0.36) BTKPIK3CAMTOR
SCHEMBL22191431 0.81 ERN1 (0.62) ERN1
SCHEMBL22191432 0.81 ERN1 (0.62) ERN1
SCHEMBL25034103 0.79 PIK3CA (0.48) PIK3CAMTORPOLB
SCHEMBL22200739 0.78 BTK (0.43) BTKPIK3CAMTORBRAF

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 BTK 1775/4885PIK3CA 211/4885MTOR 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.