SCHEMBL24874017

SCHEMBL24874017

CNc1cc(B(O)O)ccc1N=N

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 6/20 0.34
▸ CA2 P00918 3/20 0.33
▸ CA1 P00915 2/20 0.33
▸ LPL P06858 2/20 0.33
▸ LIPG Q9Y5X9 2/20 0.33
▸ TTR P02766 1/20 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
SCHEMBL3781706 0.77 CA2 (0.41) ENPP2CA2CA1LPLLIPG
SCHEMBL8342155 0.75 GAA (0.37) —
SCHEMBL14951276 0.73 HIF1A (0.43) ENPP2CA2CA1LPLLIPG
SCHEMBL3783983 0.72 ENPP2 (0.41) ENPP2CA2CA1LPLLIPG
SCHEMBL12327206 0.71 TTR (0.42) ENPP2CA2CA1LPLLIPG
SCHEMBL14951292 0.69 APP (0.40) ENPP2CA2CA1LPLLIPG
SCHEMBL22912203 0.69 TRPA1 (0.35) —
SCHEMBL3781842 0.68 PRKCI (0.50) ENPP2CA2CA1LPLLIPG
SCHEMBL12327211 0.68 TTR (0.38) ENPP2CA2CA1LPLLIPG
SCHEMBL14476938 0.68 KIF11 (0.39) —

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-2023280283-A1 COMPOUND USED AS SHP2 INHIBITOR AND USE THEREOF 浙江同源康医药股份有限公司 2023-01-12 — — WO disclosed
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