SCHEMBL29285845

SCHEMBL29285845

CP(C)(=O)c1ccc(B(O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 5/20 0.48
▸ LPL P06858 3/20 0.48
▸ LIPG Q9Y5X9 3/20 0.48
▸ ENPP2 Q13822 6/20 0.45
▸ CA1 P00915 4/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ TSHR P16473 1/20 0.42
▸ CA4 P22748 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA7 P43166 1/20 0.40
▸ CA14 Q9ULX7 1/20 0.40
▸ CA5B Q9Y2D0 1/20 0.40
▸ MGLL Q99685 2/20 0.39

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
Hydrochloric Acid SCHEMBL28914355 0.98 CA2 (0.46) CA2LPLLIPGENPP2CA1
SCHEMBL13624998 0.78 CA2 (0.50) CA2LPLLIPGENPP2CA1
SCHEMBL4729714 0.76 ENPP2 (0.48) CA2LPLLIPGENPP2CA1
SCHEMBL22655783 0.74 LPL (0.42) CA2LPLLIPGENPP2CA1
SCHEMBL27371128 0.74 ENPP2 (0.47) CA2LPLLIPGENPP2CA1
SCHEMBL14204720 0.74 ENPP2 (0.47) CA2LPLLIPGENPP2CA1
SCHEMBL18815955 0.73 CA2 (0.58) CA2ENPP2CA1CA4CA6
SCHEMBL204921 0.72 ENPP2 (0.73) CA2LPLLIPGENPP2CA1
SCHEMBL13066200 0.72 ESR1 (0.62) CA2ENPP2CA1KDM4ETSHR
SCHEMBL31713115 0.70 HPGD (0.35) TSHR

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-118339145-A Bicyclic fused ring derivatives or salts thereof and pharmaceutical compositions containing the same 柳韩洋行 2024-07-12 — — CN disclosed
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