SCHEMBL5487804

SCHEMBL5487804

O=C(Nc1ccc(/C=N/NS(=O)(=O)c2ccc3ccccc3c2)cc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 1/20 0.54
MEN1 O00255 7/20 0.53
KMT2A Q03164 7/20 0.53
MAPT P10636 6/20 0.53
ALDH1A1 P00352 4/20 0.53
HTT P42858 1/20 0.53
KAT6A Q92794 1/20 0.53
RAB9A P51151 2/20 0.52
NPC1 O15118 1/20 0.52
MITF O75030 1/20 0.52
KDM4E B2RXH2 3/20 0.51
PRMT1 Q99873 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
GAA P10253 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
TDP1 Q9NUW8 2/20 0.49
LMNA P02545 2/20 0.48
CA12 O43570 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
SCHEMBL5487810 1.00 GPR27 (0.54) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5489320 0.93 GPR27 (0.60) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5489322 0.93 GPR27 (0.60) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5482273 0.90 GPR27 (0.48) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5487532 0.89 KMT2A (0.62) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5489429 0.89 IKBKB (0.60) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5489426 0.89 IKBKB (0.60) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5484229 0.87 MEN1 (0.53) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5484233 0.87 MEN1 (0.53) GPR27MEN1KMT2AMAPTALDH1A1
SCHEMBL5492339 0.85 MEN1 (0.53) GPR27MEN1KMT2AMAPTALDH1A1

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-1845083-A2 New arylsulfonohydrazide inhibitors of enzymes MurC and MurD UNIVERZA V LJUBLJANI, FAKULTETA ZA FARMACIJO (SI) 2007-10-17 EP disclosed