SCHEMBL13064326

SCHEMBL13064326

Cc1nc(-c2ccc(-c3cccs3)s2)sc1-c1nn[nH]n1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.45
GAA P10253 4/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
GLA P06280 2/20 0.45
RAB9A P51151 2/20 0.45
CDC7 O00311 1/20 0.41
DBF4 Q9UBU7 1/20 0.41
ALDH1A1 P00352 3/20 0.39
HPGD P15428 1/20 0.36
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
DPP4 P27487 3/20 0.35
PFKFB3 Q16875 1/20 0.34
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
NPC1 O15118 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
SCHEMBL14242802 0.72 MEN1 (0.50) KDM4EGAAL3MBTL1RAB9AALDH1A1
SCHEMBL13064325 0.72 KDM4E (0.49) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL25028183 0.70 DPP4 (0.49) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL10301435 0.70 DPP4 (0.49) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL290464 0.69 KDM4E (0.46) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL289837 0.69 DPP4 (0.53) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL288846 0.68 KDM4E (0.84) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL298591 0.68 KDM4E (0.64) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL290222 0.67 KDM4E (0.64) KDM4EGAAL3MBTL1GLARAB9A
SCHEMBL298601 0.67 KDM4E (0.50) KDM4EGAAL3MBTL1GLARAB9A

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-2010128163-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION PIKE PHARMA GMBH (CH) 2010-11-11 WO disclosed