SCHEMBL30206136

SCHEMBL30206136

CN1C[C@H]2C[C@@H]1CN2c1ccc(Br)cc1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.44
CHRNA7 P36544 5/20 0.44
HRH3 Q9Y5N1 2/20 0.44
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
AKR1C3 P42330 1/20 0.36
PARP1 P09874 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
SCHEMBL30206346 1.00 KCNH2 (0.44) KCNH2CHRNA7HRH3CDK4CCND1
SCHEMBL20231005 0.84 KCNH2 (0.45) KCNH2CHRNA7CDK4CCND1PARP1
SCHEMBL7243686 0.84 KCNH2 (0.45) KCNH2CHRNA7CDK4CCND1PARP1
SCHEMBL20322515 0.84 KCNH2 (0.45) KCNH2CHRNA7CDK4CCND1PARP1
SCHEMBL24680826 0.82 HSD11B1 (0.53) KCNH2CHRNA7AKR1C3
SCHEMBL24681527 0.82 CDK4 (0.47) KCNH2CHRNA7CDK4CCND1PARP1
SCHEMBL21641736 0.82 KCNH2 (0.44) KCNH2CHRNA7CDK4CCND1PARP1
SCHEMBL24680837 0.82 HSD11B1 (0.53) KCNH2CHRNA7AKR1C3
SCHEMBL14208021 0.82 DRD2 (0.45) KCNH2CHRNA7HRH3CDK4CCND1
SCHEMBL2729685 0.82 KCNH2 (0.44) KCNH2CHRNA7CDK4CCND1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4373817-B1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2025-05-21 EP disclosed
US-20240374606-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2024-11-14 US disclosed
EP-4373817-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER Astrazeneca AB (SE) 2024-05-29 EP disclosed
CN-117693503-A Substituted pyrazine-2-carboxamides as HPK1 inhibitors for the treatment of cancer 阿斯利康(瑞典)有限公司 2024-03-12 CN disclosed
WO-2023001794-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2023-01-26 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 (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-20240374606-A1 SUBSTITUTED PYRAZINE-2-CARBOXAMIDES AS HPK1 INHIBITORS FOR THE TREATMENT OF CANCER PDXK, PGK1, PGK2 KCNH2 3130/4885CHRNA7 3949/4885HRH3 317/4885

“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.