SCHEMBL27375170

SCHEMBL27375170

O=C(NCc1cc(F)cc(-c2cnn(-c3ccc(F)cc3)c2)c1)c1ncnc2nc(C3CCCC3)[nH]c12

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 1/20 0.37
▸ DYRK1A Q13627 3/20 0.36
▸ SMO Q99835 1/20 0.35
▸ BTK Q06187 3/20 0.35
▸ NAMPT P43490 3/20 0.34
▸ TRPA1 O75762 3/20 0.33
▸ MERTK Q12866 3/20 0.33
▸ WNT1 P04628 1/20 0.33
▸ KIT P10721 1/20 0.33
▸ NR2E3 Q9Y5X4 1/20 0.33
▸ CALCA P06881 1/20 0.33

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
SCHEMBL30751355 1.00 MET (0.37) METDYRK1ASMOBTKNAMPT
SCHEMBL27376866 0.99 MET (0.37) METDYRK1ASMOBTKNAMPT
SCHEMBL30751349 0.95 NAMPT (0.37) METDYRK1ABTKNAMPTWNT1
SCHEMBL30751367 0.95 DYRK1A (0.37) METDYRK1ABTKWNT1CALCA
SCHEMBL27374607 0.95 DYRK1A (0.37) METDYRK1ABTKWNT1CALCA
SCHEMBL27377449 0.94 NAMPT (0.38) METDYRK1ASMOBTKNAMPT
SCHEMBL27375904 0.94 BTK (0.36) METDYRK1ABTKWNT1CALCA
SCHEMBL30751461 0.94 BTK (0.36) METDYRK1ABTKWNT1CALCA
SCHEMBL30751315 0.94 MET (0.36) METDYRK1ABTKWNT1CALCA
SCHEMBL27374775 0.94 MET (0.36) METDYRK1ABTKWNT1CALCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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