SCHEMBL29954973

SCHEMBL29954973

O=Cc1cccc(-c2ccc(O)c(C(=O)O)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 9/20 0.68
MCL1 Q07820 5/20 0.67
HNF4A P41235 2/20 0.67
DHFR P00374 1/20 0.67
TRIM24 O15164 1/20 0.64
TRIM33 Q9UPN9 1/20 0.64
LCK P06239 1/20 0.54
PTPN1 P18031 1/20 0.53
LDHA P00338 1/20 0.52
LDHB P07195 1/20 0.52
HAO1 Q9UJM8 1/20 0.52
ERN1 O75460 1/20 0.51
UNG P13051 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL28676105 1.00 ACMSD (0.68) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL2560683 0.87 ACMSD (0.67) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL6619210 0.85 TRIM24 (0.57) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL29955613 0.85 ACMSD (0.68) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL31312290 0.83 TRIM24 (0.62) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL2558013 0.83 TRIM24 (0.62) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL2560594 0.83 TRIM24 (0.62) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL28677845 0.82 ERN1 (0.56) ACMSDMCL1HNF4ADHFRTRIM24
SCHEMBL23143193 0.81 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK
SCHEMBL9273036 0.81 ACMSD (1.00) ACMSDMCL1HNF4ADHFRLCK

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