SCHEMBL27376555

SCHEMBL27376555

O=C(NCc1cc(F)cc(-c2cnn(-c3ccc(F)cc3)c2)c1)c1ncnc2nc(C3CCOC3)[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 1/20 0.35
▸ MAPK1 P28482 2/20 0.34
▸ MAP4K4 O95819 2/20 0.33
▸ BTK Q06187 4/20 0.33
▸ GRIN2B Q13224 1/20 0.32
▸ DYRK1A Q13627 1/20 0.32
▸ TRPA1 O75762 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ KIT P10721 1/20 0.31
▸ NR2E3 Q9Y5X4 1/20 0.31
▸ NAMPT P43490 2/20 0.31

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
SCHEMBL30751076 1.00 MET (0.35) METMAPK1MAP4K4BTKGRIN2B
SCHEMBL30751355 0.92 MET (0.37) METBTKDYRK1ATRPA1KIT
SCHEMBL27375170 0.92 MET (0.37) METBTKDYRK1ATRPA1KIT
SCHEMBL27376866 0.91 MET (0.37) METBTKDYRK1ATRPA1KIT
SCHEMBL21174259 0.89 MET (0.46) METMAPK1BTKCHRM1KIT
SCHEMBL30751074 0.89 MET (0.36) METMAPK1BTKDYRK1ATRPA1
SCHEMBL30751316 0.89 MET (0.36) METMAPK1BTKDYRK1ATRPA1
SCHEMBL30751057 0.89 MET (0.36) METDYRK1ATRPA1KITNR2E3
SCHEMBL27377149 0.89 MET (0.36) METMAPK1BTKDYRK1ATRPA1
SCHEMBL30751091 0.88 MET (0.35) METBTKDYRK1ATRPA1KIT

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
Send feedback