SCHEMBL29952024

SCHEMBL29952024

CC(=O)N1Cc2ccc(B(O)O)cc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NOTUM Q6P988 2/20 0.37
HSD17B3 P37058 15/20 0.37
PRF1 P14222 1/20 0.35

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
SCHEMBL29951586 0.88 PRF1 (0.42) KDM4EHTTSMN1; SMN2NOTUMHSD17B3
SCHEMBL2627990 0.80 DDB1 (0.44) KDM4EPRF1
SCHEMBL29955852 0.76 ACACB (0.43) KDM4EPRF1
SCHEMBL31373871 0.74 KDM4E (0.59) KDM4EHTTSMN1; SMN2NOTUMHSD17B3
SCHEMBL29956886 0.74 ALDH1A1 (0.42) KDM4EHTTPRF1
SCHEMBL29952168 0.72 NPC1 (0.59) KDM4EHTTSMN1; SMN2
SCHEMBL2559394 0.72 KDM4E (0.43) KDM4ESMN1; SMN2PRF1
SCHEMBL29953994 0.71 KDM4E (0.37) KDM4E
SCHEMBL28586692 0.68 PBRM1 (0.58)
SCHEMBL29957631 0.68 HSD17B3 (0.44) KDM4EHTTSMN1; SMN2NOTUMHSD17B3

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