SCHEMBL298601

SCHEMBL298601

Cc1nnc(-c2ccc(-c3cccs3)s2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 5/20 0.50
EPHX2 P34913 1/20 0.50
DPP4 P27487 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 3/20 0.42
RAB9A P51151 3/20 0.42
LTA4H P09960 1/20 0.42
HPGD P15428 5/20 0.41
HTT P42858 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NPC1 O15118 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL11701666 0.89 KDM4E (0.61) KDM4EALDH1A1HSD17B10EPHX2L3MBTL1
SCHEMBL16785692 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL16785688 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL14437828 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL16785691 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL16785690 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL498537 0.77 DPP4 (0.53) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL23611278 0.77 DPP4 (0.65) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL13707354 0.77 DPP4 (0.65) KDM4EALDH1A1HSD17B10EPHX2DPP4
SCHEMBL1105086 0.77 DPP4 (0.65) KDM4EALDH1A1HSD17B10EPHX2DPP4

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