SCHEMBL8657015

SCHEMBL8657015

Cn1c(CCCC[N])nc2ccncc21

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
AOC2 O75106 2/20 0.41
PDE10A Q9Y233 3/20 0.39
TLR7 Q9NYK1 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL8654063 0.88 MAPT (0.47) MAPTPDE10ATLR7HDAC6SMN1; SMN2
SCHEMBL8088160 0.85 MAPT (0.65) MAPTAOC2PDE10ATLR7HDAC6
SCHEMBL15857985 0.78 RPS6KA5 (0.40) MAPTAOC2PDE10ASMN1; SMN2NPC1
SCHEMBL10388000 0.77 MAPT (0.47) MAPTPDE10ATLR7HDAC6SMN1; SMN2
SCHEMBL10281995 0.76 MAPT (0.42) MAPTAOC2PDE10AHDAC6SMN1; SMN2
SCHEMBL10388001 0.75 MAPT (0.49) MAPTPDE10ATLR7HDAC6SMN1; SMN2
SCHEMBL9690915 0.75 ATM (0.47) MAPTPDE10AHDAC6SMN1; SMN2NPC1
SCHEMBL17897213 0.74 LMNA (0.44) AOC2PDE10ASMN1; SMN2NPC1RAB9A
SCHEMBL18306494 0.74 NPC1 (0.45) MAPTAOC2SMN1; SMN2NPC1RAB9A
SCHEMBL10313053 0.74 SMN1; SMN2 (0.44) MAPTAOC2PDE10ASMN1; SMN2NPC1

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
EP-0680967-B1 Erythromycin derivatives, their process of preparation and their use as medicaments HOECHST MARION ROUSSEL INC (FR) 1998-10-14 EP disclosed
EP-0680967-A1 Erythromycin derivatives, their process of preparation and their use as medicaments ROUSSEL-UCLAF (FR) 1995-11-08 EP disclosed