SCHEMBL22190877

SCHEMBL22190877

CC(C)n1c(=O)c(-c2ccc(NS(=O)(=O)Cc3ccccc3)c(F)c2)nc2cnc(S(C)(=O)=O)nc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 7/20 0.56
CYP1A2 P05177 8/20 0.40
USP2 O75604 6/20 0.40
CYP3A4 P08684 5/20 0.40
CYP2C9 P11712 5/20 0.40
CYP2C19 P33261 5/20 0.40
MAPK1 P28482 4/20 0.40
HSD17B10 Q99714 7/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
ALDH1A1 P00352 6/20 0.36
CASP1 P29466 6/20 0.36
CASP7 P55210 5/20 0.36
HIF1A Q16665 5/20 0.36
LMNA P02545 2/20 0.36
RECQL P46063 2/20 0.36
TSHR P16473 2/20 0.36
JAK1 P23458 1/20 0.36
CYP2D6 P10635 1/20 0.35
CLK4 Q9HAZ1 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
SCHEMBL29356032 1.00 ERN1 (0.56) ERN1CYP1A2USP2CYP3A4CYP2C9
SCHEMBL25035369 0.89 ERN1 (0.57) ERN1CYP1A2USP2CYP3A4CYP2C9
SCHEMBL29357948 0.89 ERN1 (0.56) ERN1CYP1A2USP2CYP3A4CYP2C9
SCHEMBL22190959 0.89 ERN1 (0.56) ERN1CYP1A2USP2CYP3A4CYP2C9
SCHEMBL22190987 0.85 ERN1 (0.49) ERN1CYP1A2USP2CYP3A4HSD17B10
SCHEMBL29355891 0.85 ERN1 (0.49) ERN1CYP1A2USP2CYP3A4HSD17B10
SCHEMBL22190725 0.85 ERN1 (0.58) ERN1CYP1A2USP2CYP3A4HSD17B10
SCHEMBL29356153 0.85 ERN1 (0.58) ERN1CYP1A2USP2CYP3A4HSD17B10
SCHEMBL25035335 0.83 ERN1 (0.58) ERN1CYP1A2USP2CYP3A4CYP2C9
SCHEMBL22191281 0.81 ERN1 (0.64) ERN1CYP1A2USP2CYP3A4CYP2C9

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 8 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
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
CN-113508115-A Pyridopyrimidinone and pteridinone compounds as inhibitors of endoribonuclease inositol requiring enzyme I (IRE I A) for the treatment of cancer diseases 基因泰克公司 2021-10-15 CN disclosed
WO-2020142612-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) 2020-07-09 WO disclosed
WO-2020142612-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) 2020-07-09 WO 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 3167/4885CYP1A2 1312/4885USP2 4550/4885
US-12344603-B2 Pyrido-pyrimidinone and pteridinone compounds and methods of use TYMP, TYMS, DPYD ERN1 3167/4885CYP1A2 1312/4885USP2 4550/4885

“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.