SCHEMBL29952969

SCHEMBL29952969

COc1ccc(B(O)O)c(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NNMT P40261 3/20 0.37
ENPP2 Q13822 2/20 0.36
HTT P42858 3/20 0.35
ALDH1A1 P00352 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 2/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL2725012 1.00 POLB (0.38) POLBTDP1NNMTENPP2HTT
SCHEMBL29653296 0.78 NNMT (0.50) POLBTDP1NNMTENPP2HTT
SCHEMBL248283 0.78 NNMT (0.50) POLBTDP1NNMTENPP2HTT
SCHEMBL321488 0.78 POLB (0.52) POLBTDP1NNMTENPP2HTT
SCHEMBL29956451 0.76 POLB (0.38) POLBTDP1NNMTENPP2SIRT2
SCHEMBL29955515 0.76 NNMT (0.41) POLBTDP1NNMTENPP2HTT
SCHEMBL16294781 0.76 POLB (0.38) POLBTDP1NNMTENPP2SIRT2
SCHEMBL20360819 0.75 BTK (0.36) POLBTSHRSMN1; SMN2KMT2A
SCHEMBL28314922 0.75 POLB (0.40) POLBTDP1NNMTHTTALDH1A1
SCHEMBL25515471 0.74 ALDH1A1 (0.36) POLBTDP1ENPP2HTTALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4678641-A1 QUINOLINONE COMPOUND AND NAPHTHYRIDINONE COMPOUND AND USE THEREOF Shanghai Helioson Pharmaceutical Co., Ltd. (CN) 2026-01-14 EP disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed