SCHEMBL30879252

SCHEMBL30879252

COc1ccccc1Nc1ncc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)cc(=O)n(-c3ccc(NS(C)(=O)=O)cc3)c2n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.47
LRRK2 Q5S007 4/20 0.42
BRD4 O60885 3/20 0.42
MAP4K1 Q92918 3/20 0.42
MAPK3 P27361 1/20 0.42
DCLK1 O15075 2/20 0.41
MAPK7 Q13164 1/20 0.41
ALK Q9UM73 1/20 0.41
EGFR P00533 9/20 0.40
BTK Q06187 1/20 0.40

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
SCHEMBL30878843 0.93 BTK (0.47) LRRK2BRD4MAP4K1DCLK1MAPK7
SCHEMBL30878664 0.90 MAP4K1 (0.51) LRRK2MAP4K1ALKEGFRBTK
SCHEMBL30878864 0.89 MAP4K1 (0.50) FLT3LRRK2MAP4K1ALKEGFR
SCHEMBL30878675 0.88 MAP4K1 (0.48) FLT3LRRK2MAP4K1ALKEGFR
SCHEMBL30878814 0.88 FLT3 (0.47) FLT3MAP4K1ALKEGFRBTK
SCHEMBL30878336 0.87 FLT3 (0.51) FLT3LRRK2BRD4MAP4K1MAPK3
SCHEMBL30878733 0.87 FLT3 (0.48) FLT3MAP4K1EGFRBTK
SCHEMBL30878716 0.87 FLT3 (0.48) FLT3MAP4K1EGFRBTK
SCHEMBL30879087 0.85 ZAP70 (0.44) LRRK2MAP4K1ALKEGFRBTK
SCHEMBL30879114 0.85 BTK (0.56) FLT3EGFRBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4612148-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER Cancer Research Technology Limited (GB) 2025-09-10 EP disclosed
WO-2024094963-A1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE AND 7-AMINO-1-PYRIMIDO[4,5-D]PYRIMIDIN-2(1 H)-ONE DERIVATIVES AS EGFR INHIBITORS FOR THE TREATMENT OF CANCER CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2024-05-10 WO disclosed