SCHEMBL6166444

SCHEMBL6166444

CS(=O)(=O)c1ccc(C(OC2C=CCCC2)C(=O)NC2=NCCS2)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
FFAR2 O15552 1/20 0.43
KCNH2 Q12809 2/20 0.40
NPC1 O15118 6/20 0.39
RAB9A P51151 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
GAA P10253 1/20 0.38
GCK P35557 1/20 0.37
APOBEC3A P31941 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL2652100 0.81 KCNH2 (0.53) LMNAFFAR2KCNH2KMT2AMEN1
SCHEMBL2653133 0.80 SLC6A3 (0.41) LMNAKCNH2GCK
SCHEMBL2652717 0.80 KCNH2 (0.39) LMNAKCNH2GCK
SCHEMBL2651926 0.80 KCNH2 (0.39) LMNAKCNH2ALDH1A1GCK
SCHEMBL2652192 0.69 FFAR2 (0.46) LMNAFFAR2KCNH2SMN1; SMN2ALDH1A1
SCHEMBL2652710 0.69 LMNA (0.44) LMNA
SCHEMBL2652305 0.69 SLC6A3 (0.54) LMNA
SCHEMBL2653474 0.69 KCNH2 (0.56) LMNAFFAR2KCNH2KMT2AMEN1
SCHEMBL2653272 0.67 LMNA (0.43) LMNA
SCHEMBL2652746 0.67 KCNH2 (0.44) LMNAKCNH2ALDH1A1GCK

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-1305301-B1 ALPHA-ACYL AND ALPHA-HETEROATOM-SUBSTITUTED BENZENE ACETAMIDE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2005-06-15 EP claimed