SCHEMBL29356154

SCHEMBL29356154

O=c1c(-c2ccc(NS(=O)(=O)Cc3ccccc3F)c(F)c2)cc2cnc(N[C@@H]3CNC[C@@H](F)C3)nc2n1CCO

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 0.53
MAPK14 Q16539 3/20 0.38
BRAF P15056 5/20 0.38
RIPK2 O43353 1/20 0.36
ACVR1 Q04771 1/20 0.36
NOD2 Q9HC29 1/20 0.36
STK4 Q13043 2/20 0.35
STK3 Q13188 2/20 0.35
SIK2 Q9H0K1 2/20 0.35
STK26 Q9P289 2/20 0.35
STK24 Q9Y6E0 2/20 0.35
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33

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
SCHEMBL22190895 1.00 ERN1 (0.53) ERN1MAPK14BRAFRIPK2ACVR1
SCHEMBL22200422 0.92 ERN1 (0.53) ERN1MAPK14BRAFSTK4STK3
Hydrochloric Acid SCHEMBL22191006 0.91 ERN1 (0.52) ERN1MAPK14BRAFSTK4STK3
Hydrochloric Acid SCHEMBL29353020 0.91 ERN1 (0.52) ERN1MAPK14BRAFSTK4STK3
SCHEMBL22190623 0.88 ERN1 (0.64) ERN1MAPK14BRAF
SCHEMBL29356695 0.88 ERN1 (0.64) ERN1MAPK14BRAF
SCHEMBL22200523 0.86 ERN1 (0.58) ERN1MAPK14BRAF
SCHEMBL22200520 0.86 ERN1 (0.58) ERN1MAPK14BRAF
SCHEMBL22200604 0.86 ERN1 (0.58) ERN1MAPK14BRAF
SCHEMBL22200525 0.86 ERN1 (0.58) ERN1MAPK14BRAF

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3941919-B1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AS INHIBITORS OF ENDORIBONUCLEASE INOSITOL REQUIRING ENZYME I (IRE I ALPHA) FOR THE TREATMENT OF CANCER DISEASES. GENENTECH INC (US) 2025-12-24 EP disclosed
US-12344603-B2 Pyrido-pyrimidinone and pteridinone compounds and methods of use GENENTECH, INC. (US) 2025-07-01 US disclosed
US-20230047209-A1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AND METHODS OF USE PARAZA PHARMA, INC. (CA) 2023-02-16 US disclosed
EP-3941919-A1 PYRIDO-PYRIMIDINONE AND PTERIDINONE COMPOUNDS AS INHIBITORS OF ENDORIBONUCLEASE INOSITOL REQUIRING ENZYME I (IRE I ALPHA) FOR THE TREATMENT OF CANCER DISEASES Genentech, Inc. (US) 2022-01-26 EP 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 (2 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 3167/4885MAPK14 2813/4885BRAF 563/4885
US-12344603-B2 Pyrido-pyrimidinone and pteridinone compounds and methods of use TYMP, TYMS, DPYD ERN1 3167/4885MAPK14 2813/4885BRAF 563/4885

“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.