SCHEMBL29356229

SCHEMBL29356229

CC(C)n1c(=O)c(-c2ccc(NS(=O)(=O)c3ccccc3OC(F)(F)F)nc2)cc2cnc(NC3CCC(N(C)C)CC3)nc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 4/20 0.53
ADRA2A P08913 2/20 0.40
NPY5R Q15761 2/20 0.40
MCHR1 Q99705 2/20 0.40
MAPK8 P45983 9/20 0.40
MAPK10 P53779 8/20 0.40
MAPK9 P45984 7/20 0.40
CCNT1 O60563 1/20 0.38
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38
CDK6 Q00534 1/20 0.38
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MAPK14 Q16539 1/20 0.36
GSPT1 P15170 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 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
SCHEMBL22191167 1.00 ERN1 (0.53) ERN1ADRA2ANPY5RMCHR1MAPK8
SCHEMBL22191165 1.00 ERN1 (0.53) ERN1ADRA2ANPY5RMCHR1MAPK8
SCHEMBL22191224 0.91 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL29354881 0.91 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL22191226 0.91 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL29356573 0.88 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL22190714 0.88 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL22190715 0.88 ERN1 (0.53) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL22191124 0.86 ERN1 (0.55) ERN1MAPK8MAPK10MAPK9CCNT1
SCHEMBL22191127 0.86 ERN1 (0.55) ERN1MAPK8MAPK10MAPK9CCNT1

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 3167/4885ADRA2A 2728/4885NPY5R 1648/4885
US-12344603-B2 Pyrido-pyrimidinone and pteridinone compounds and methods of use TYMP, TYMS, DPYD ERN1 3167/4885ADRA2A 2728/4885NPY5R 1648/4885

“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.