SCHEMBL5269971

SCHEMBL5269971

O=C(c1n[nH]cc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1)N1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
RXFP1 Q9HBX9 1/20 0.47
ACLY P53396 3/20 0.46
HSD17B10 Q99714 1/20 0.45
MAPK1 P28482 2/20 0.45
GAA P10253 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
HPGD P15428 1/20 0.45
CCKBR P32239 1/20 0.43
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 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
SCHEMBL5271053 0.93 L3MBTL1 (0.51) L3MBTL1RXFP1HSD17B10GAAHPGD
SCHEMBL5266983 0.86 RXFP1 (0.49) L3MBTL1RXFP1HSD17B10GAAMAPT
SCHEMBL5274022 0.86 L3MBTL1 (0.46) L3MBTL1RXFP1HSD17B10MAPK1GAA
SCHEMBL5271765 0.86 ALDH1A1 (0.48) L3MBTL1RXFP1HSD17B10MAPTKMT2A
SCHEMBL5267751 0.86 NPC1 (0.56) L3MBTL1HSD17B10GAAMEN1MAPT
SCHEMBL5273212 0.85 ALDH1A1 (0.47) L3MBTL1RXFP1HSD17B10GAAMEN1
SCHEMBL5268091 0.84 LMNA (0.55) L3MBTL1HSD17B10GAAMAPTKMT2A
SCHEMBL5265743 0.83 ALDH1A1 (0.53) L3MBTL1GAAMEN1MAPTHTT
SCHEMBL5272349 0.80 MEN1 (0.47) ACLYMAPK1GAAMEN1MAPT
SCHEMBL4284633 0.79 KMT2A (0.49) ACLYMAPK1GAAMEN1MAPT

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
EP-1847531-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-24 EP disclosed