SCHEMBL29356017

SCHEMBL29356017

CC(C)n1c(=O)c(-c2ccc(NS(=O)(=O)C3CCCCC3)c(F)c2)cc2cnc(NC3CCC(N(C)C)CC3)nc21

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 5/20 0.62
CCND1 P24385 3/20 0.43
CCNE1 P24864 3/20 0.43
CDK2 P24941 3/20 0.43
CDK6 Q00534 3/20 0.43
CCNT1 O60563 1/20 0.43
CDK4 P11802 1/20 0.43
CDK9 P50750 1/20 0.43
MAPK8 P45983 9/20 0.42
MAPK10 P53779 6/20 0.42
MAPK9 P45984 5/20 0.42
JAK2 O60674 1/20 0.40
BRD4 O60885 1/20 0.40
BRAF P15056 1/20 0.39
FGFR1 P11362 1/20 0.38

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
SCHEMBL22191097 1.00 ERN1 (0.62) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL22191099 1.00 ERN1 (0.62) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL22200375 0.99 ERN1 (0.63) ERN1CCND1CCNE1CDK2CDK6
Hydrochloric Acid SCHEMBL22191731 0.99 ERN1 (0.62) ERN1CCND1CCNE1CDK2CDK6
Hydrochloric Acid SCHEMBL29357910 0.99 ERN1 (0.62) ERN1CCND1CCNE1CDK2CDK6
Hydrochloric Acid SCHEMBL22191729 0.99 ERN1 (0.62) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL25035632 0.91 ERN1 (0.59) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL22191160 0.90 ERN1 (0.66) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL22191162 0.90 ERN1 (0.66) ERN1CCND1CCNE1CDK2CDK6
SCHEMBL29356211 0.90 ERN1 (0.66) ERN1CCND1CCNE1CDK2CDK6

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 3167/4885CCND1 1637/4885CCNE1 1158/4885
US-12344603-B2 Pyrido-pyrimidinone and pteridinone compounds and methods of use TYMP, TYMS, DPYD ERN1 3167/4885CCND1 1637/4885CCNE1 1158/4885

“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.