SCHEMBL29956948

SCHEMBL29956948

OCc1ccc(B(O)O)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.36
HSD17B10 Q99714 1/20 0.34
VHL P40337 2/20 0.33
ELOC Q15369 1/20 0.33
ELOB Q15370 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
RECQL P46063 1/20 0.32
TSHR P16473 1/20 0.32
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
NPC1 O15118 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
FYN P06241 1/20 0.31
F11 P03951 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL28374997 0.76
SCHEMBL29955021 0.75 CA1 (0.55) HSD17B10TSHRLPLLIPGNPC1
SCHEMBL29258492 0.72 KDM1A (0.43) HSD17B10MKNK1MKNK2RECQLTSHR
SCHEMBL10092631 0.70 ENPP2 (0.40) ENPP2TSHRLPLLIPGF11
SCHEMBL29954840 0.70 ENPP2 (0.40) ENPP2HSD17B10RECQLNPC1RAB9A
SCHEMBL4140258 0.70 CCR1 (0.41) HSD17B10MKNK1MKNK2RECQLTSHR
SCHEMBL150687 0.70
SCHEMBL344739 0.68
SCHEMBL2643095 0.68
SCHEMBL127567 0.68

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