SCHEMBL31498360

SCHEMBL31498360

O=C(OCc1ccccc1Br)c1cc(O)ccc1O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.56
▸ CA1 P00915 3/20 0.56
▸ CA2 P00918 3/20 0.56
▸ CA7 P43166 3/20 0.56
▸ CA9 Q16790 3/20 0.56
▸ CA14 Q9ULX7 3/20 0.56
▸ MMP1 P03956 1/20 0.50
▸ MMP2 P08253 1/20 0.50
▸ MMP9 P14780 1/20 0.50
▸ MMP12 P39900 1/20 0.50
▸ EGFR P00533 2/20 0.49
▸ MAPT P10636 3/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ SERPINE1 P05121 1/20 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
SCHEMBL1655944 0.78 TDP1 (0.73) CA12CA1CA2CA7CA9
SCHEMBL7707224 0.76 MMP1 (0.52) MMP1MMP2MMP9MMP12MAPT
SCHEMBL19024920 0.76 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL13286843 0.76 CA12 (0.73) CA12CA1CA2CA7CA9
SCHEMBL31498361 0.75 MAOB (0.55) CA12CA1CA2CA7CA9
SCHEMBL23484371 0.74 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL7089488 0.74 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL7765576 0.73 MAPT (0.56) MMP1MMP2MMP9MMP12MAPT
SCHEMBL257907 0.73 TDP1 (0.59) EGFRRAB9ANPC1KMT2APOLB
SCHEMBL94305 0.73 TDP1 (0.69) MAPTRAB9ANPC1KMT2ATDP1

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
CN-119843294-A Preparation method of axial chiral biaryl diphenol derivative 江苏信和生物医药有限公司 2025-04-18 — — CN disclosed
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