SCHEMBL29776283

SCHEMBL29776283

CCc1cn2c(n1)c1nc(Nc3ccc(N4CCN(C)CC4)c(C)c3)ncc1c(=O)n2-c1c(Cl)cccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ WEE1 P30291 7/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ KCNH2 Q12809 3/20 0.51
▸ TNK2 Q07912 3/20 0.51
▸ EGFR P00533 7/20 0.49
▸ TTK P33981 1/20 0.46
▸ BRD4 O60885 1/20 0.46
▸ CSF1R P07333 1/20 0.45

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
SCHEMBL21876474 1.00 WEE1 (0.56) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL21876504 0.93 WEE1 (0.55) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL29776134 0.93 WEE1 (0.55) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL21876459 0.90 TNK2 (0.52) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL21876481 0.86 WEE1 (0.57) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL29776165 0.86 WEE1 (0.58) WEE1CYP3A4KCNH2TNK2BRD4
SCHEMBL21876523 0.86 WEE1 (0.58) WEE1CYP3A4KCNH2TNK2BRD4
SCHEMBL21876527 0.85 WEE1 (0.55) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL20649234 0.82 WEE1 (0.54) WEE1CYP3A4KCNH2TNK2EGFR
SCHEMBL21876470 0.82 WEE1 (0.55) WEE1CYP3A4KCNH2TNK2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118338905-A Use of Wee1 kinase inhibitors in the treatment of cancer 上海瑛派药业有限公司 2024-07-12 — — CN claimed
CN-117202908-A Use of Wee1 kinase inhibitors in the treatment of cancer diseases 上海瑛派药业有限公司 2023-12-08 — — CN claimed
WO-2023093840-A1 USE OF WEE1 KINASE INHIBITORS IN THE TREATMENT OF CANCER IMPACT THERAPEUTICS (SHANGHAI) , INC (CN) 2023-06-01 — — WO claimed
WO-2022188802-A1 USE OF WEE1 KINASE INHIBITORS IN THE TREATMENT OF CANCER IMPACT THERAPEUTICS (SHANGHAI) , INC (CN) 2022-09-15 — — WO claimed
CN-110914277-B Imidazo [1,2-b ] pyrimido [4,5-d ] pyridazin-5 (6H) -one compounds and application thereof 上海瑛派药业有限公司 2022-08-09 — — CN claimed
CN-118338905-A Use of Wee1 kinase inhibitors in the treatment of cancer 上海瑛派药业有限公司 2024-07-12 — — CN disclosed
CN-117202908-A Use of Wee1 kinase inhibitors in the treatment of cancer diseases 上海瑛派药业有限公司 2023-12-08 — — CN disclosed
WO-2023093840-A1 USE OF WEE1 KINASE INHIBITORS IN THE TREATMENT OF CANCER IMPACT THERAPEUTICS (SHANGHAI) , INC (CN) 2023-06-01 — — WO disclosed
WO-2022188802-A1 USE OF WEE1 KINASE INHIBITORS IN THE TREATMENT OF CANCER IMPACT THERAPEUTICS (SHANGHAI) , INC (CN) 2022-09-15 — — WO disclosed
CN-110914277-B Imidazo [1,2-b ] pyrimido [4,5-d ] pyridazin-5 (6H) -one compounds and application thereof 上海瑛派药业有限公司 2022-08-09 — — CN disclosed
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