SCHEMBL29809882

SCHEMBL29809882

c1ncc2cncnc2n1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.46
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
PIK3CG P48736 1/20 0.33
HSP90AA1 P07900 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CA P42336 1/20 0.32
CDC25B P30305 1/20 0.30

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
SCHEMBL140301 1.00 EGFR (0.46) EGFRMETAP2METAP1PIK3CGHSP90AA1
SCHEMBL30446266 0.84 EGFR (0.37) EGFR
SCHEMBL3234117 0.81 EGFR (0.43) EGFRMETAP2METAP1PIK3CGPIK3CD
SCHEMBL30826363 0.77 EGFR (0.35) EGFR
SCHEMBL29364990 0.77 EGFR (0.50) EGFRMETAP2METAP1HSP90AA1PIK3CD
SCHEMBL30502330 0.77 EGFR (0.50) EGFRMETAP2METAP1HSP90AA1PIK3CD
SCHEMBL12414 0.77 EGFR (0.50) EGFRMETAP2METAP1HSP90AA1PIK3CD
SCHEMBL5804048 0.77 EGFR (0.35) EGFRCDC25B
SCHEMBL30876200 0.75 EGFR (0.48) EGFRMETAP2METAP1HSP90AA1PIK3CD
SCHEMBL11385198 0.75 CCR1 (0.50) EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120019059-A Novel ACC inhibitors 辉瑞公司 2025-05-16 CN disclosed
CN-119431310-A Preparation method of obutinib and intermediate compound thereof 北京诺诚健华医药科技有限公司 2025-02-14 CN disclosed
EP-4405337-A1 FUSED PYRIMIDINE DERIVATIVES AS KRAS ONCOPROTEIN INHIBITORS Beta Pharma, Inc. (US) 2024-07-31 EP disclosed
EP-4405337-A1 FUSED PYRIMIDINE DERIVATIVES AS KRAS ONCOPROTEIN INHIBITORS Beta Pharma, Inc. (US) 2024-07-31 EP disclosed
CN-118339146-A Fused pyrimidine derivatives as KRAS oncoprotein inhibitors 贝达医药公司 2024-07-12 CN disclosed
CN-118339146-A Fused pyrimidine derivatives as KRAS oncoprotein inhibitors 贝达医药公司 2024-07-12 CN disclosed
CN-113637005-B KRAS inhibitors for cancer treatment 泰励生物科技(上海)有限公司 2024-05-24 CN disclosed
EP-3543242-C0 8,9-DIHYDROIMIDAZOLE[1,2-A]PYRIMIDO[5,4-E]PYRIMIDINE-5(6H)-KETONE COMPOUND IMPACT THERAPEUTICS SHANGHAI INC (CN) 2024-01-03 EP disclosed
EP-3543242-B1 8,9-DIHYDROIMIDAZOLE[1,2-A]PYRIMIDO[5,4-E]PYRIMIDINE-5(6H)-KETONE COMPOUND IMPACT THERAPEUTICS SHANGHAI INC (CN) 2024-01-03 EP disclosed
WO-2023101928-A1 FUSED PYRIMIDINE DERIVATIVES AS KRAS ONCOPROTEIN INHIBITORS BETA PHARMA, INC. (US) 2023-06-08 WO disclosed
WO-2023101928-A1 FUSED PYRIMIDINE DERIVATIVES AS KRAS ONCOPROTEIN INHIBITORS BETA PHARMA, INC. (US) 2023-06-08 WO disclosed
CN-114920738-A KRas inhibitors for cancer treatment 泰励生物科技(上海)有限公司 2022-08-19 CN disclosed
WO-2020157487-A9 GENETIC CONSTRUCT AND USES THEREOF THE UNIVERSITY OF NOTTINGHAM (GB) 2022-07-14 WO disclosed