SCHEMBL27376453

SCHEMBL27376453

O=C(O)c1ncnc2nc(C3CCC(F)(F)C3)[nH]c12

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PBK Q96KB5 4/20 0.34
▸ S1PR4 O95977 5/20 0.33
▸ S1PR1 P21453 5/20 0.33
▸ S1PR3 Q99500 5/20 0.33
▸ S1PR5 Q9H228 5/20 0.33
▸ CD38 P28907 2/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.30
▸ PARP1 P09874 1/20 0.30
▸ PARP2 Q9UGN5 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
SCHEMBL30751428 1.00 PBK (0.34) PBKS1PR4S1PR1S1PR3S1PR5
SCHEMBL27374320 0.81 ADORA1 (0.42) PBK
SCHEMBL30751343 0.81 ADORA1 (0.42) PBK
SCHEMBL29634667 0.71 MET (0.45) —
SCHEMBL30751356 0.69 PBK (0.40) PBKPARP1
SCHEMBL18757752 0.67 AKT2 (0.40) EGLN1
SCHEMBL27374309 0.67 PBK (0.39) PBK
SCHEMBL19865524 0.66 EGLN1 (0.35) EGLN1
SCHEMBL18776143 0.66 ADORA3 (0.38) EGLN1
SCHEMBL18785698 0.63 PI4KA (0.41) EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4567035-A1 NOVEL COMPOUND AS HYPOXIA-INDUCIBLE FACTOR 1(HIF-1) INHIBITOR OR VASCULAR ENDOTHELIAL GROWTH FACTOR (VEGF) INHIBITOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Nextgen Bioscience Co., Ltd. (KR) 2025-06-11 — — EP 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
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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