SCHEMBL4573048

SCHEMBL4573048

C[C]1Nc2ccccc2N=C1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 10/20 0.40
GAA P10253 5/20 0.40
MCL1 Q07820 1/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 3/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
DRD2 P14416 3/20 0.39
DRD4 P21917 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
MAPK1 P28482 2/20 0.38
CHRM2 P08172 2/20 0.35

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
SCHEMBL1773395 0.79 DRD2 (0.51) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL12355741 0.79 LMNA (0.40) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL9114944 0.75 MAPT (0.38) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL30133223 0.72 KMT2A (0.50) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL23721149 0.71 MAPT (0.36) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL8718926 0.71 GAA (0.62) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL12208493 0.70 DRD2 (0.61) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL10761480 0.68 LMNA (0.36) LMNASMN1; SMN2MAPTGAAMCL1
SCHEMBL7507906 0.67 ALDH1A1 (0.61) LMNASMN1; SMN2MAPTMEN1KMT2A
SCHEMBL15943307 0.67 RAB9A (0.47) LMNASMN1; SMN2MAPTGAAMCL1

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
WO-2009001127-A1 CYANOCYCLOPROPYLCARBOXAMIDES AS CATHEPSIN INHIBITORS ASTRAZENECA AB (SE) 2008-12-31 WO disclosed