SCHEMBL29956493

SCHEMBL29956493

NNC(=O)c1ccc(B(O)O)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
KDM4E B2RXH2 3/20 0.64
ALDH1A1 P00352 5/20 0.50
TTR P02766 3/20 0.44
GFER P55789 1/20 0.43
POLB P06746 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
THRB P10828 1/20 0.41
RECQL P46063 1/20 0.41
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 1/20 0.39
FLT1 P17948 3/20 0.38
FLT4 P35916 3/20 0.38
KDR P35968 3/20 0.38
JAK2 O60674 2/20 0.38
TYK2 P29597 2/20 0.38
GAA P10253 2/20 0.38

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
SCHEMBL248676 0.83 TTR (0.44) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL29955017 0.82 POLB (0.51) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL2930047 0.80 TTR (0.53) MAPTKDM4EALDH1A1TTRHPGD
SCHEMBL16096308 0.79 ALDH1A1 (0.43) MAPTKDM4EALDH1A1GFERPOLB
SCHEMBL29954470 0.79 POLB (0.54) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL4043611 0.79 POLB (0.54) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL4047592 0.79 ALDH1A1 (0.50) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL29956917 0.79 ALDH1A1 (0.50) MAPTKDM4EALDH1A1TTRPOLB
SCHEMBL1127878 0.78 KDM4E (1.00) MAPTKDM4EALDH1A1POLBL3MBTL1
SCHEMBL396220 0.78 TSHR (0.59) MAPTKDM4EALDH1A1TTRPOLB

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