SCHEMBL5266801

SCHEMBL5266801

O=C(Nc1ccccc1)c1n[nH]cc1NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 3/20 0.54
PGR P06401 1/20 0.47
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
AKR1C3 P42330 1/20 0.45
GLO1 Q04760 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
KAT6A Q92794 1/20 0.44
PFKFB3 Q16875 1/20 0.44
PLAU P00749 2/20 0.44
SLC16A3 O15427 2/20 0.44

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
SCHEMBL5270764 0.87 KMT2A (0.52) GPR27KMT2AMEN1ALDH1A1LMNA
SCHEMBL5269789 0.86 MEN1 (0.51) PGRKMT2AMEN1ALDH1A1LMNA
SCHEMBL5267179 0.85 KMT2A (0.50) GPR27KMT2AMEN1ALDH1A1LMNA
SCHEMBL5268282 0.84 TDP1 (0.54) GPR27PGRKMT2AMEN1ALDH1A1
SCHEMBL5268976 0.84 MEN1 (0.49) KMT2AMEN1ALDH1A1LMNASMN1; SMN2
SCHEMBL5269774 0.84 KDM4E (0.55) GPR27KMT2AMEN1ALDH1A1LMNA
SCHEMBL5268210 0.84 SMN1; SMN2 (0.54) GPR27KMT2AMEN1ALDH1A1LMNA
SCHEMBL5270621 0.84 GPR27 (0.51) GPR27KMT2AMEN1ALDH1A1LMNA
SCHEMBL5271604 0.84 MEN1 (0.55) GPR27KMT2AMEN1ALDH1A1
SCHEMBL5268920 0.84 KCNA5 (0.47) KMT2AMEN1ALDH1A1LMNAGLO1

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