SCHEMBL29951491

SCHEMBL29951491

Cc1nc(O)ccc1B(O)O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.32
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32

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
SCHEMBL489376 0.78 CCR1 (0.40) CA2LPLLIPG
SCHEMBL30788696 0.78 CCR1 (0.40) CA2LPLLIPG
SCHEMBL29911929 0.74 CHRNB2 (0.33) CA2LPLLIPG
SCHEMBL29952243 0.74 ENPP2 (0.31)
SCHEMBL29698271 0.74 CA2 (0.31) CA2LPLLIPG
SCHEMBL1937542 0.74 CHRNB2 (0.33) CA2LPLLIPG
SCHEMBL29911747 0.74 NOS2 (0.54) CA2LPLLIPG
SCHEMBL17027805 0.74 NOS2 (0.54) CA2LPLLIPG
SCHEMBL29952049 0.74
SCHEMBL18606203 0.74 CA2 (0.31) CA2LPLLIPG

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed