SCHEMBL299865

SCHEMBL299865

Cc1csc(-c2ccc(Br)s2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.45
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HSD17B10 Q99714 3/20 0.45
ALDH1A1 P00352 3/20 0.45
RAB9A P51151 3/20 0.45
PPARG P37231 2/20 0.45
NCOA2 Q15596 2/20 0.45
RXFP1 Q9HBX9 2/20 0.45
TP53 P04637 2/20 0.45
HPGD P15428 2/20 0.45
NPC1 O15118 2/20 0.45
NCOA1 Q15788 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 2/20 0.44

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
SCHEMBL890218 0.82 NPC1 (0.50) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL10147188 0.75 PDE10A (0.40) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL289627 0.74 KDM4E (0.50) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL2387268 0.73 KDM4E (0.54) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL13680730 0.73 LMNA (0.49) KDM4EMAPTSMN1; SMN2ALDH1A1RAB9A
SCHEMBL18157874 0.72 SMN1; SMN2 (0.55) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL4160754 0.72 KDM4E (0.54) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL10301440 0.70 MAPT (0.56) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1
SCHEMBL289445 0.69 CYP19A1 (0.48) KDM4EHSD17B10ALDH1A1TP53HPGD
SCHEMBL23367838 0.69 RAB9A (0.56) KDM4EMAPTSMN1; SMN2HSD17B10ALDH1A1

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