SCHEMBL9424948

SCHEMBL9424948

O=C(O)c1cc2cc(O)c(O)cc2o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 8/20 0.55
CSNK2A1 P68400 4/20 0.54
CSNK2A2 P19784 3/20 0.54
CSNK2B P67870 3/20 0.54
CSNK2A3 Q8NEV1 3/20 0.54
PIM2 Q9P1W9 3/20 0.50
LMNA P02545 3/20 0.49
MAPT P10636 3/20 0.49
CYP3A4 P08684 2/20 0.49
TP53 P04637 1/20 0.47
KDM4E B2RXH2 3/20 0.47
GLA P06280 2/20 0.47
AKR1B1 P15121 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
PTGS1 P23219 2/20 0.47
CA12 O43570 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
BCHE P06276 1/20 0.47

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
SCHEMBL4310530 0.78 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL11746037 0.78 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL6407371 0.76 FLT3 (0.76) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL648526 0.76 FLT3 (0.76) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL6239973 0.76 PIM1 (0.60) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL29628919 0.75 GPR35 (0.76) KDM4ECA12ALDH1A1CYP1A2CA9
SCHEMBL9319353 0.75 BCL2L1 (0.46) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL5563883 0.75 AKR1B1 (0.65) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL4766674 0.75 PIM1 (0.55) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL980268 0.75 GPR35 (0.76) KDM4ECA12ALDH1A1CYP1A2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420069-A2 Heterocyclic hydrazide derivatives of monocyclic beta-lactam antibiotics E.R. SQUIBB & SONS, INC. (US) 1991-04-03 EP claimed
US-5318963-A Heterocyclic hydrazide derivatives of monocyclic β-lactam antibiotics E. R. SQUIBB & SONS, INC. (US) 1994-06-07 US disclosed
EP-0420069-A2 Heterocyclic hydrazide derivatives of monocyclic beta-lactam antibiotics E.R. SQUIBB & SONS, INC. (US) 1991-04-03 EP disclosed