SCHEMBL30475469

SCHEMBL30475469

Oc1cccc(-c2ccc(OCc3ccccc3)nc2OCc2ccccc2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.41
SQOR Q9Y6N5 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.37
CYP1A2 P05177 2/20 0.37
PTGS1 P23219 1/20 0.37
SLC6A2 P23975 1/20 0.37
CYP2C19 P33261 1/20 0.37
PTGS2 P35354 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HIF1A Q16665 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TRPV3 Q8NET8 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
PTGER1 P34995 1/20 0.37
MCL1 Q07820 1/20 0.37

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
SCHEMBL25824951 1.00 GRM5 (0.41) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL25819527 0.85 L3MBTL1 (0.43) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL19586404 0.83 ALDH1A1 (0.43) GRM5SQORL3MBTL1LMNATRPV3
SCHEMBL29170223 0.82 GRM5 (0.44) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL21055273 0.79 LMNA (0.48) GRM5L3MBTL1LMNACYP1A2PTGS1
SCHEMBL24207230 0.79 LMNA (0.47) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL31390651 0.79 LMNA (0.44) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL19585970 0.78 GRM5 (0.41) GRM5SQORL3MBTL1LMNACYP1A2
SCHEMBL30475462 0.78 SQOR (0.44) GRM5SQORL3MBTL1TRPV3MAPK1
SCHEMBL25035127 0.78 SQOR (0.44) GRM5SQORL3MBTL1TRPV3MAPK1

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
CN-116322700-B Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2024-08-20 CN disclosed
CN-116322700-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2023-06-23 CN disclosed