SCHEMBL2659460

SCHEMBL2659460

Cc1cc(NS(=O)(=O)c2sccc2C)c2[nH]c(C(N)=S)cc2c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HRH4 Q9H3N8 2/20 0.34
NPC1 O15118 2/20 0.32
POLB P06746 2/20 0.32
RAB9A P51151 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
EDNRB P24530 2/20 0.32
EDNRA P25101 2/20 0.32
XDH P47989 1/20 0.32
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
SLC9A1 P19634 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CYTH2 Q99418 1/20 0.30

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
SCHEMBL2660266 0.90 MEN1 (0.39) MEN1KMT2AHRH4NPC1POLB
SCHEMBL2661534 0.87 TUBB4A (0.36) HRH4PKM
SCHEMBL2660468 0.87 DAO (0.39) MEN1KMT2AHRH4NPC1POLB
SCHEMBL2659960 0.83 KDM4E (0.45) MEN1KMT2ANPC1RAB9AXDH
SCHEMBL2659039 0.82 MEN1 (0.33) MEN1KMT2APKMGAA
SCHEMBL2660262 0.80 PPIA (0.32) HRH4
SCHEMBL2660619 0.79 FBP1 (0.35) MEN1KMT2APKMMAPTL3MBTL1
SCHEMBL2660294 0.77 NSD2 (0.37) MEN1KMT2AHRH4
SCHEMBL2659637 0.76 PLA2G7 (0.36) HRH4NPC1GAAMAPT
SCHEMBL2660500 0.75 KDM4E (0.36) MEN1KMT2AGAAMAPT

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-2074119-A1 INDOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-07-01 EP disclosed
WO-2008050821-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-05-02 WO disclosed