SCHEMBL27760293

SCHEMBL27760293

O=C(c1ccc2c(c1)cc(C(=O)N1CCS(O)(O)CC1)n2-c1ccc(F)cc1)N1CCN(C2CCCC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.52
MGLL Q99685 5/20 0.48
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
FAAH O00519 1/20 0.45
L3MBTL3 Q96JM7 2/20 0.44
NAMPT P43490 1/20 0.42

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
SCHEMBL3540283 0.93 HRH3 (0.52) HRH3MGLLHTTL3MBTL1KDM4E
SCHEMBL27739853 0.91 HRH3 (0.50) HRH3L3MBTL1KDM4EALDH1A1KMT2A
SCHEMBL27739844 0.91 HRH3 (0.50) HRH3HTTL3MBTL1KDM4EALDH1A1
SCHEMBL27739845 0.90 HTT (0.54) HRH3MGLLHTTL3MBTL1KDM4E
SCHEMBL27739839 0.90 HRH3 (0.54) HRH3MGLLHTTL3MBTL1KDM4E
SCHEMBL27760290 0.88 HRH3 (0.52) HRH3MGLLHTTL3MBTL1KDM4E
SCHEMBL3541563 0.87 HRH3 (0.52) HRH3MGLLHTTL3MBTL1KDM4E
SCHEMBL27739850 0.86 HRH3 (0.51) HRH3L3MBTL1L3MBTL3
SCHEMBL28775838 0.85 L3MBTL1 (0.55) HRH3HTTL3MBTL1KDM4EMEN1
SCHEMBL27739852 0.84 HRH3 (0.52) HRH3MGLLHTTL3MBTL1KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101421235-A 5-amido-2-amide indoles HOFFMANN LA ROCHE (CH) 2009-04-29 CN disclosed