SCHEMBL29951753

SCHEMBL29951753

O=Cc1nccc(C(=O)O)c1OC1CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 5/20 0.37
KDM5B Q9UGL1 3/20 0.36
KDM5A P29375 2/20 0.36
ASPH Q12797 2/20 0.35
KDM8 Q8N371 2/20 0.35
KDM4E B2RXH2 1/20 0.35
DHODH Q02127 2/20 0.34
SCD O00767 1/20 0.34
POLB P06746 1/20 0.34
CCNB2 O95067 1/20 0.34
CCNE2 O96020 1/20 0.34
CDK1 P06493 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
CCNB3 Q8WWL7 1/20 0.34
KMT2A Q03164 1/20 0.33
PARP10 Q53GL7 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL29955125 0.87 PARP10 (0.41) KMOKDM4ESCDPARP10
SCHEMBL29953922 0.83 KAT2B (0.41) SCDCCNB2CCNE2CDK1CCNB1
SCHEMBL29951808 0.77 ROCK1 (0.33) SCDPOLB
SCHEMBL29951053 0.77 KMO (0.41) KMOSCDPOLB
SCHEMBL31357026 0.75 POLB (0.43) KMOSCDPOLBKMT2ALMNA
SCHEMBL29955320 0.73 LOXL2 (0.38) SCDPOLB
SCHEMBL29951693 0.73 KMO (0.36) KMOASPHKDM8KDM4ESCD
SCHEMBL29951320 0.73 SCD (0.32) SCDPOLB
SCHEMBL29956893 0.73 CA1 (0.39) KDM4EDHODHPOLBSMN1; SMN2
SCHEMBL548553 0.71 KDM4E (0.43) KDM5BKDM5AASPHKDM8KDM4E

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