SCHEMBL7440372

SCHEMBL7440372

CCOC(=O)CC(C)(C)N(C)c1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
HSD11B1 P28845 1/20 0.44
POLB P06746 2/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 3/20 0.43
HPGD P15428 2/20 0.43
HTT P42858 2/20 0.43
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLQ O75417 1/20 0.39
CASP1 P29466 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL11760696 0.80 SMN1; SMN2 (0.45) LMNAPOLBALDH1A1KDM4EHSD17B10
SCHEMBL7437685 0.80 SMN1; SMN2 (0.50) HSD11B1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL3254096 0.78 LMNA (0.51) LMNAALDH1A1KDM4EHSD17B10HPGD
SCHEMBL15150399 0.76 LMNA (0.49) LMNAALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL16415718 0.75 LMNA (0.47) LMNAPOLBALDH1A1KDM4EHSD17B10
SCHEMBL4840210 0.75 POLB (0.46) LMNAPOLBTP53SMN1; SMN2MEN1
SCHEMBL1120660 0.74 LMNA (0.50) LMNAPOLBALDH1A1KDM4EHSD17B10
SCHEMBL28291723 0.74 LMNA (0.50) LMNAHSD11B1POLBALDH1A1KDM4E
SCHEMBL9069781 0.73 LMNA (0.48) LMNAPOLBKDM4EHSD17B10HTT
SCHEMBL9304780 0.71 ALDH1A1 (0.47) LMNAHSD11B1POLBALDH1A1HSD17B10

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
EP-0640594-A1 Hydantoin derivative as metalloprotease inhibitor FUJIREBIO INC. (JP) 1995-03-01 EP disclosed