SCHEMBL289627

SCHEMBL289627

Cc1csc(-c2ccc(-c3cccs3)s2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.50
MAPT P10636 3/20 0.50
RAB9A P51151 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HPGD P15428 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
DPP4 P27487 4/20 0.44
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
PDE10A Q9Y233 1/20 0.42
CYP2E1 P05181 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL299124 0.88 KDM4E (0.63) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL298505 0.80 KDM4E (0.46) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL890218 0.78 NPC1 (0.50) KDM4EMAPTRAB9AMEN1KMT2A
SCHEMBL16785690 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL14437828 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL16785691 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL16785692 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL16785688 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL498537 0.76 DPP4 (0.53) KDM4EMAPTRAB9AL3MBTL1MEN1
SCHEMBL23611278 0.75 DPP4 (0.65) KDM4EMAPTRAB9AL3MBTL1MEN1

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-2427447-A2 SMALL MOLECULE INHIBITORS OF INFLUENZA A AND B VIRUS AND RESPIRATORY SYNCYTIAL VIRUS REPLICATION Pike Pharma GmbH (CH) 2012-03-14 EP disclosed
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