SCHEMBL31236655

SCHEMBL31236655

CCCCCCOc1c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c2c1=O

nearest known ligand 0.92

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 7/20 0.92
ALOX5 P09917 6/20 0.72
KDM4E B2RXH2 1/20 0.69
MEN1 O00255 1/20 0.69
MMP1 P03956 1/20 0.69
POLB P06746 1/20 0.69
GAA P10253 1/20 0.69
MAPT P10636 1/20 0.69
APEX1 P27695 1/20 0.69
HTT P42858 1/20 0.69
RECQL P46063 1/20 0.69
BLM P54132 1/20 0.69
KMT2A Q03164 1/20 0.69
HSD17B10 Q99714 1/20 0.69
ACE2 Q9BYF1 1/20 0.59

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
SCHEMBL31236658 1.00 POLH (0.92) POLHALOX5KDM4EMEN1MMP1
SCHEMBL20630781 1.00 POLH (0.92) POLHALOX5KDM4EMEN1MMP1
SCHEMBL20630786 1.00 POLH (0.92) POLHALOX5KDM4EMEN1MMP1
SCHEMBL25262255 0.96 POLH (1.00) POLHALOX5KDM4EMEN1MMP1
SCHEMBL17620378 0.92 POLH (0.89) POLHALOX5KDM4EMEN1MMP1
SCHEMBL23442033 0.89 POLH (0.78) POLHALOX5KDM4EMEN1MMP1
SCHEMBL30326405 0.89 POLH (0.78) POLHALOX5KDM4EMEN1MMP1
SCHEMBL29139772 0.89 POLH (0.78) POLHALOX5KDM4EMEN1MMP1
SCHEMBL25304942 0.88 POLH (1.00) POLHALOX5KDM4EMEN1MMP1
SCHEMBL30663836 0.88 POLH (1.00) POLHALOX5KDM4EMEN1MMP1

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
CN-110831589-B Medical compounds 维拉萨卢斯里切尔卡有限公司 2025-01-03 CN disclosed