SCHEMBL29400320

SCHEMBL29400320

CP(C)(=O)c1ccccc1Nc1nc(Cl)ncc1Cl

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CDK7 P50613 1/20 0.60
▸ CDK9 P50750 1/20 0.60
▸ INSR P06213 3/20 0.58
▸ IGF1R P08069 3/20 0.58
▸ ALK Q9UM73 3/20 0.58
▸ MAP4K1 Q92918 7/20 0.53
▸ EGFR P00533 2/20 0.53
▸ PTK2 Q05397 7/20 0.52

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
SCHEMBL11916362 1.00 CDK7 (0.60) CDK7CDK9INSRIGF1RALK
SCHEMBL14240767 0.88 CDK7 (0.48) CDK7CDK9INSRIGF1RALK
SCHEMBL19313060 0.88 CDK7 (0.59) CDK7CDK9INSRIGF1RALK
SCHEMBL30503695 0.88 CDK7 (0.48) CDK7CDK9INSRIGF1RALK
SCHEMBL26717249 0.88 INSR (0.72) CDK7CDK9INSRIGF1RALK
SCHEMBL30173407 0.86 IGF1R (0.49) CDK7CDK9INSRIGF1RALK
SCHEMBL22246100 0.86 MAP4K1 (0.48) CDK7CDK9INSRIGF1RALK
SCHEMBL13832181 0.86 IGF1R (0.49) CDK7CDK9INSRIGF1RALK
SCHEMBL14240702 0.86 CDK7 (0.58) CDK7CDK9INSRIGF1RALK
SCHEMBL29833319 0.86 CDK7 (0.61) CDK7CDK9INSRIGF1RALK

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112239422-B Bugatinib intermediate, salt thereof, preparation method thereof and preparation method of brigatinib 河北化工医药职业技术学院 2022-07-22 — — CN claimed
CN-120025316-A Compound for targeted degradation of ALK protein, and preparation method and application thereof 成都分迪药业有限公司 2025-05-23 — — CN disclosed
CN-119968373-A Aromatic heterocyclic compound and preparation method thereof 上海翊石医药科技有限公司 2025-05-09 — — CN disclosed
CN-119735613-A Crystalline forms of 5-chloro-N4- [2- (dimethylphosphoryl) phenyl ] -N2- { 2-methoxy-4- [4- (4-methylpiperazin-1-yl) piperidin-1-yl ] phenyl } pyrimidine-2, 4-diamine 武田药品工业株式会社 2025-04-01 — — CN disclosed
CN-119143806-B Dimethyl phosphine oxide substituted aniline pyrimidine derivative targeting EGFR mutation, preparation method and application thereof, and medicine prepared from dimethyl phosphine oxide substituted aniline pyrimidine derivative 四川大学华西医院 2025-03-11 — — CN disclosed
CN-119552192-A Preparation method of ALK kinase inhibitor 齐鲁制药有限公司 2025-03-04 — — CN disclosed
CN-119143806-A Dimethyl phosphine oxide substituted aniline pyrimidine derivative targeting EGFR mutation, preparation method and application thereof, and medicine prepared from dimethyl phosphine oxide substituted aniline pyrimidine derivative 四川大学华西医院 2024-12-17 — — CN disclosed
CN-115697993-B Pyrimidine compounds as AXL inhibitors 南京正大天晴制药有限公司 2024-12-10 — — CN disclosed
CN-118976029-A Pharmaceutical composition for preventing or treating parkinson's disease or nonalcoholic steatohepatitis 韩国化学研究院 2024-11-19 — — CN disclosed
CN-114829344-B Pyrimidine derivatives and pharmaceutical compositions containing the same 韩国化学研究院 2024-08-13 — — CN disclosed
CN-113302196-B EGFR inhibitor, composition and application thereof 贝达药业股份有限公司 2023-08-04 — — CN disclosed
CN-113004252-B Aryl imidazole derivative and application thereof 江苏先声药业有限公司 2023-06-09 — — CN disclosed
WO-2023070114-A2 REVERSIBLE LYSINE COVALENT MODIFIERS OF EGFR AND USES THEREOF TERREMOTO BIOSCIENCES, INC. (US) 2023-04-27 — — WO disclosed
CN-115697993-A Pyrimidines as AXL inhibitors 南京正大天晴制药有限公司 2023-02-03 — — CN disclosed
WO-2023278325-A1 BIFUNCTIONAL COMPOUNDS THAT DEGRADE ALK AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-01-05 — — WO disclosed
CN-112771032-B Pyrimidine pyrazole compounds as fourth generation EGFR inhibitors 江苏先声药业有限公司 2023-01-03 — — CN disclosed
CN-114829344-A Novel pyrimidine derivative and use thereof 韩国化学研究院 2022-07-29 — — CN disclosed
CN-112239422-B Bugatinib intermediate, salt thereof, preparation method thereof and preparation method of brigatinib 河北化工医药职业技术学院 2022-07-22 — — CN disclosed
CN-110357889-B Protein degradation targeting compound, anti-tumor application thereof, intermediate thereof and application of intermediate 上海科技大学 2022-03-15 — — CN disclosed
CN-110467637-B Bisaminyl chloropyrimidine compound containing phosphine oxide substituted aniline, preparation method and application thereof 北京赛特明强医药科技有限公司 2022-02-18 — — CN disclosed
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