SCHEMBL8534280

SCHEMBL8534280

CS(=O)(=O)c1nnc(-c2ccco2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.55
ALDH1A1 P00352 10/20 0.54
RAB9A P51151 10/20 0.47
NPC1 O15118 9/20 0.47
SMN1; SMN2 Q16637 6/20 0.47
HPGD P15428 3/20 0.47
HTT P42858 1/20 0.46
HSD17B10 Q99714 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
POLB P06746 1/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
TDP1 Q9NUW8 3/20 0.43
XBP1 P17861 1/20 0.43
USP2 O75604 2/20 0.43
LMNA P02545 1/20 0.42
PPARG P37231 1/20 0.41
NCOA2 Q15596 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL10054150 0.74 KDM4E (0.64) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL7905128 0.73 CA1 (0.51) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL23212489 0.72 ALDH1A1 (0.65) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL570555 0.70 ALDH1A1 (1.00) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL970071 0.70 ALDH1A1 (0.62) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL8536020 0.70 KDM4E (0.58) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL10220036 0.70 KDM4E (0.58) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL10272059 0.70 KDM4E (0.58) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL9091999 0.70 ALDH1A1 (0.45) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL6693068 0.69 SIRT1 (0.58) KDM4EALDH1A1RAB9ANPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5780392-A Heterocyclyl-1,3,4-thiadiazolyloxyacetamides and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
EP-0755395-A1 HETEROCYCLYL-1,3,4-THIADIAZOLYLOXYACETAMIDES BAYER AG (DE) 1997-01-29 EP disclosed
WO-1995027711-A1 HETEROCYCLYL-1,3,4-THIADIAZOLYLOXYACETAMIDES BAYER AKTIENGESELLSCHAFT (DE) 1995-10-19 WO disclosed