SCHEMBL290214

SCHEMBL290214

Cc1nc(-c2ccc(-c3ccc4sccc4c3)s2)sc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
RAB9A P51151 3/20 0.51
GAA P10253 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
ALDH1A1 P00352 4/20 0.46
TARBP2 Q15633 2/20 0.42
KMT2A Q03164 1/20 0.41
DYRK1A Q13627 1/20 0.41
XDH P47989 5/20 0.41
CSNK2A1 P68400 1/20 0.39
ABCC4 O15439 1/20 0.39
ABCB11 O95342 1/20 0.39
PGR P06401 1/20 0.39
CHRM1 P11229 1/20 0.39
PDE4A P27815 1/20 0.39
BLVRB P30043 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL289624 0.85 KDM4E (0.58) KDM4ERAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL289866 0.81 SMN1; SMN2 (0.59) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL289411 0.81 KDM4E (0.53) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL290134 0.79 KDM4E (0.75) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL289596 0.78 SMN1; SMN2 (0.74) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL289408 0.77 SMN1; SMN2 (0.72) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL289635 0.76 KDM4E (0.57) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL290201 0.76 KDM4E (0.60) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL299617 0.75 KDM4E (0.50) KDM4ERAB9AGAASMN1; SMN2NPC1
SCHEMBL289699 0.75 KDM4E (0.61) KDM4ERAB9AGAASMN1; 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-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