SCHEMBL30751109

SCHEMBL30751109

CN1CCC(c2nc3ncnc(C(=O)NCc4cc(F)cc(-c5cnn(C)c5)c4)c3[nH]2)C1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 4/20 0.46
▸ DYRK1A Q13627 4/20 0.38
▸ GSK3B P49841 3/20 0.38
▸ KIT P10721 4/20 0.37
▸ MAPK1 P28482 1/20 0.35
▸ BTK Q06187 3/20 0.35
▸ ERCC1 P07992 1/20 0.34
▸ ERCC4 Q92889 1/20 0.34
▸ PDPK1 O15530 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34
▸ ROS1 P08922 1/20 0.34
▸ ALK Q9UM73 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL27376452 1.00 MET (0.46) METDYRK1AGSK3BKITMAPK1
SCHEMBL27376365 0.95 MET (0.47) METDYRK1AGSK3BKITMAPK1
SCHEMBL30751108 0.95 MET (0.47) METDYRK1AGSK3BKITMAPK1
SCHEMBL21174281 0.92 MET (0.50) METKITMAPK1BTKPDPK1
SCHEMBL21174231 0.92 MET (0.49) METDYRK1AKITMAPK1BTK
SCHEMBL21174064 0.92 MET (0.49) METDYRK1AKITMAPK1BTK
SCHEMBL21174232 0.90 MET (0.46) METKITMAPK1BTKPDPK1
SCHEMBL30751474 0.89 MET (0.47) METDYRK1AGSK3BKITMAPK1
SCHEMBL27376359 0.89 MET (0.47) METDYRK1AGSK3BKITMAPK1
SCHEMBL21174213 0.89 MET (0.46) METKITMAPK1BTKPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119654324-A Novel compounds as hypoxia inducible factor 1 (HIF-1) inhibitors or Vascular Endothelial Growth Factor (VEGF) inhibitors and pharmaceutical compositions comprising the same 株式会社次代生物科学 2025-03-18 — — CN claimed
WO-2024030000-A1 NOVEL COMPOUND AS HYPOXIA-INDUCIBLE FACTOR 1(HIF-1) INHIBITOR OR VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 넥스트젠바이오사이언스 2024-02-08 — — WO claimed
CN-119654324-A Novel compounds as hypoxia inducible factor 1 (HIF-1) inhibitors or Vascular Endothelial Growth Factor (VEGF) inhibitors and pharmaceutical compositions comprising the same 株式会社次代生物科学 2025-03-18 — — CN disclosed
WO-2024030000-A1 NOVEL COMPOUND AS HYPOXIA-INDUCIBLE FACTOR 1(HIF-1) INHIBITOR OR VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 넥스트젠바이오사이언스 2024-02-08 — — WO disclosed
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