SCHEMBL28655613

SCHEMBL28655613

Cc1cc(C(=O)O)c2cc(-c3ccc(F)cc3)oc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 7/20 0.50
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ GABRP O00591 4/20 0.44
▸ GABRD O14764 4/20 0.44
▸ GABRA1 P14867 4/20 0.44
▸ GABRB1 P18505 4/20 0.44
▸ GABRG2 P18507 4/20 0.44
▸ GABRB3 P28472 4/20 0.44
▸ GABRA5 P31644 4/20 0.44
▸ GABRA3 P34903 4/20 0.44
▸ GABRA2 P47869 4/20 0.44
▸ GABRB2 P47870 4/20 0.44
▸ GABRA4 P48169 4/20 0.44
▸ GABRE P78334 4/20 0.44
▸ GABRA6 Q16445 4/20 0.44
▸ GABRG1 Q8N1C3 4/20 0.44
▸ GABRG3 Q99928 4/20 0.44

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
SCHEMBL28929133 0.86 MAOB (0.48) MAOBNPC1RAB9AGABRPGABRD
SCHEMBL28670379 0.85 ADORA3 (0.56) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL28660360 0.82 TNKS (0.54) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL28660357 0.80 EIF4A1 (0.52) DHODH
SCHEMBL28663810 0.79 ALDH1A1 (0.64) NPC1RAB9AMEN1KMT2A
SCHEMBL28655615 0.77 DHODH (0.53) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL28654878 0.77 CA12 (0.49) MAOBNPC1RAB9AMEN1KMT2A
SCHEMBL3903274 0.76 NPC1 (0.71) NPC1RAB9AMEN1KMT2ANOTUM
SCHEMBL28677812 0.76 CA12 (0.42) MAOBNPC1RAB9A
SCHEMBL19929823 0.75 ADORA3 (0.54) MAOBNPC1RAB9AMEN1KMT2A

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
CN-113754619-B Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium 广州大学 2022-12-20 — — CN disclosed
CN-113754619-A Method for preparing polysubstituted benzofuran-4-formic acid compound under catalysis of ruthenium 广州大学 2021-12-07 — — CN disclosed
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