SCHEMBL30751397

SCHEMBL30751397

CC(C)(C)OC(=O)NCc1cc(F)cc(-c2cn[nH]c2)c1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 15/20 0.49
▸ ROCK1 Q13464 7/20 0.49
▸ ACACB O00763 1/20 0.44
▸ ACACA Q13085 1/20 0.44
▸ GRM2 Q14416 1/20 0.42
▸ DYRK1A Q13627 1/20 0.41
▸ L3MBTL1 Q9Y468 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
SCHEMBL27375085 1.00 ROCK2 (0.49) ROCK2ROCK1ACACBACACAGRM2
SCHEMBL31614327 0.86 ROCK2 (0.47) ROCK2ROCK1ACACBACACADYRK1A
SCHEMBL27376908 0.86 ROCK2 (0.47) ROCK2ROCK1ACACBACACADYRK1A
SCHEMBL30751435 0.82 ROCK2 (0.53) ROCK2ROCK1ACACBACACA
SCHEMBL31457047 0.82 ROCK2 (0.53) ROCK2ROCK1ACACBACACA
SCHEMBL27375848 0.81 GRM2 (0.42) ROCK2ROCK1GRM2DYRK1AL3MBTL1
SCHEMBL30751378 0.81 GRM2 (0.42) ROCK2ROCK1GRM2DYRK1AL3MBTL1
SCHEMBL12791343 0.81 GRM2 (0.46) GRM2L3MBTL1
SCHEMBL30751448 0.81 GRM2 (0.43) GRM2DYRK1AL3MBTL1
SCHEMBL30751445 0.81 GRM2 (0.41) GRM2DYRK1AL3MBTL1

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-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
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