SCHEMBL5265873

SCHEMBL5265873

O=C(c1n[nH]cc1NS(=O)(=O)c1cccc2cccnc12)N1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PKLR P30613 14/20 0.52
GAA P10253 1/20 0.51
GFER P55789 1/20 0.51
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
MMP2 P08253 1/20 0.49
PKM P14618 2/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL5271807 0.82 KCNA5 (0.54) GAAHPGDTSHRMMP2MEN1
SCHEMBL5267782 0.81 GAA (0.55) GAAHPGDTSHRMMP2MEN1
SCHEMBL5274014 0.80 ALDH1A1 (0.54) PKLRGAAGFERHPGDTSHR
SCHEMBL5265907 0.79 MEN1 (0.57) GAAHPGDMMP2MEN1KMT2A
SCHEMBL5271053 0.77 L3MBTL1 (0.51) GAAHPGD
SCHEMBL5270341 0.77 MEN1 (0.54) PKLRGAAHPGDMMP2MEN1
SCHEMBL5273212 0.76 ALDH1A1 (0.47) GAATSHRMEN1KMT2A
SCHEMBL5270886 0.75 SMN1; SMN2 (0.57) GAAHPGDMMP2MEN1KMT2A
SCHEMBL5265851 0.74 MCL1 (0.48) HPGDTSHRMEN1KMT2A
SCHEMBL5269971 0.74 L3MBTL1 (0.50) GAAHPGDMEN1KMT2A

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