SCHEMBL17090261

SCHEMBL17090261

Cc1cc(CNc2ccc(N3C[C@@H](C)O[C@@H](C)C3)cc2)ccc1NS(=O)(=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
KDM4E B2RXH2 7/20 0.39
GAA P10253 6/20 0.39
ALOX15 P16050 5/20 0.39
ALOX12 P18054 5/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPK1 P28482 3/20 0.39
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 3/20 0.36
TSHR P16473 3/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
THRB P10828 1/20 0.36
GFER P55789 2/20 0.35
TRPV1 Q8NER1 1/20 0.35

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
SCHEMBL13565111 1.00 MAPT (0.40) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL11935309 0.87 MAPT (0.46) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL11941262 0.87 MAPT (0.46) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL17090289 0.87 MAPT (0.46) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL13565349 0.86 MAPT (0.40) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL13565508 0.86 MAPT (0.37) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL13565361 0.86 MAPT (0.37) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL17090283 0.86 MAPT (0.40) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL11936099 0.83 L3MBTL1 (0.36) MAPTKDM4EGAAALOX15ALOX12
SCHEMBL11941265 0.83 L3MBTL1 (0.36) MAPTKDM4EGAAALOX15ALOX12

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
US-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed