SCHEMBL29127652

SCHEMBL29127652

O=C(O)c1cc2oc(C(=O)O)cc2o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.54
CSNK2A1 P68400 4/20 0.54
CSNK2A2 P19784 3/20 0.54
CSNK2B P67870 3/20 0.54
CSNK2A3 Q8NEV1 3/20 0.54
DAO P14920 1/20 0.52
KDM4E B2RXH2 4/20 0.52
USP2 O75604 1/20 0.52
PTGS1 P23219 1/20 0.52
AKR1B1 P15121 1/20 0.48
GLA P06280 1/20 0.48
MAPT P10636 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MCL1 Q07820 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL30662296 0.79 PIM1 (0.47) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL70569 0.74 KDM4E (0.52) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL29460209 0.74 FLT3 (0.74) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL9424948 0.74 PIM1 (0.55) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL155789 0.74 FLT3 (0.74) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
Benzene SCHEMBL28107977 0.74 FLT3 (0.74) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL5154557 0.74 DAO (0.45) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
Hydrochloric Acid SCHEMBL3611971 0.73 FLT3 (0.71) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL27669244 0.73 FLT3 (0.71) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL4310530 0.73 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3

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-115368559-B Hydrogen-bond-induced bio-based fluorescent polyamide and preparation method thereof 烟台大学 2023-12-22 CN disclosed