SCHEMBL7440376

SCHEMBL7440376

CCOC(=O)CC(C)(C)NCc1ccccn1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 2/20 0.45
GAA P10253 2/20 0.45
KDM4E B2RXH2 1/20 0.44
ALOX15 P16050 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL16839803 0.81 PPID (0.44) ALDH1A1LMNAKDM4EHPGDHSD17B10
SCHEMBL1344175 0.79 PPID (0.58) ALDH1A1SMN1; SMN2LMNAMAPTGAA
SCHEMBL30700389 0.78 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNARAB9AMAPT
SCHEMBL75805 0.78 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2LMNARAB9AMAPT
Hydrochloric Acid SCHEMBL10886319 0.78 PPID (0.57) ALDH1A1SMN1; SMN2LMNAMAPTGAA
SCHEMBL31215234 0.77 PPID (0.64) ALDH1A1SMN1; SMN2RAB9AKDM4EALOX15
SCHEMBL2039737 0.77 PPID (0.64) ALDH1A1SMN1; SMN2RAB9AKDM4EALOX15
SCHEMBL31215205 0.77 MAPT (0.60) ALDH1A1SMN1; SMN2LMNARAB9AMAPT
Hydrochloric Acid SCHEMBL5434602 0.77 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2LMNARAB9AMAPT
SCHEMBL7712013 0.77 MAPT (0.60) ALDH1A1SMN1; SMN2LMNARAB9AMAPT

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