SCHEMBL6508208

SCHEMBL6508208

CS(=O)(=O)Nc1nc(N)c(CCO)s1.Cc1ccccc1S(=O)(=O)Nc1nc(N)c(CCO)s1.Nc1nc(NS(=O)(=O)c2ccccc2)sc1CCO.Nc1nc(NS(=O)(=O)c2nccs2)sc1CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.38
LMNA P02545 3/20 0.38
KDM4E B2RXH2 3/20 0.38
PKM P14618 2/20 0.38
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP2C9 P11712 2/20 0.35
EDNRA P25101 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SCN3A Q9NY46 2/20 0.34
SCN1A P35498 1/20 0.34
SCN1B Q07699 1/20 0.34
SCN5A Q14524 1/20 0.34

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
SCHEMBL6506679 0.70 GAA (0.35) GAALMNAKDM4EPKMALDH1A1
SCHEMBL6505221 0.69 HSD11B1 (0.50) GAAMEN1KMT2ACYP2C9
SCHEMBL6502170 0.67 SCN1A (0.38) LMNAKDM4EPKMALDH1A1CYP2C9
SCHEMBL326633 0.61 ALDH1A1 (0.71) LMNAKDM4EPKMALDH1A1MEN1
Hydrochloric Acid SCHEMBL27575105 0.60 ALDH1A1 (0.69) LMNAKDM4EPKMALDH1A1MEN1
SCHEMBL6502050 0.59 PKM (0.47) GAALMNAKDM4EPKMALDH1A1
SCHEMBL3611324 0.57 ALDH1A1 (0.58) GAAPKMALDH1A1MEN1KMT2A
SCHEMBL1492421 0.57 ALDH1A1 (0.60) GAALMNAKDM4EPKMALDH1A1
SCHEMBL29494648 0.57 ALDH1A1 (0.60) GAALMNAKDM4EPKMALDH1A1
SCHEMBL3070565 0.57 ALDH1A1 (0.68) LMNAKDM4EPKMALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005014591-A1 2-ACYLAMINO OR 2-SULFONYLAMINO-1, 3-THIAZOLES AS COUPLERS FOR THE OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2005-02-17 WO claimed
WO-2005014591-A1 2-ACYLAMINO OR 2-SULFONYLAMINO-1, 3-THIAZOLES AS COUPLERS FOR THE OXIDATION DYEING OF KERATIN FIBRES L'OREAL (FR) 2005-02-17 WO disclosed