SCHEMBL6563297

SCHEMBL6563297

CCOC(=O)c1csc(NC(=O)C(CC2CCCC2)c2ccc(S(=O)(=O)F)cc2)n1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 15/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 2/20 0.48
GLA P06280 1/20 0.47

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
SCHEMBL2646219 0.92 GCK (0.63) GCKSMN1; SMN2
SCHEMBL2647382 0.91 GCK (0.53) GCKSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL2646731 0.88 SMN1; SMN2 (0.57) GCKSMN1; SMN2LMNA
SCHEMBL2645677 0.86 SMN1; SMN2 (0.53) GCKSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL2648531 0.86 SMN1; SMN2 (0.55) GCKSMN1; SMN2KDM4ELMNA
SCHEMBL3389490 0.85 GCK (0.74) GCK
SCHEMBL27465165 0.84 SMN1; SMN2 (0.53) GCKSMN1; SMN2KDM4E
SCHEMBL2648477 0.84 SMN1; SMN2 (0.53) GCKSMN1; SMN2KDM4ELMNA
SCHEMBL2645568 0.84 GCK (0.66) GCK
SCHEMBL4256251 0.84 GCK (0.61) GCK

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-1169312-B1 GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2004-10-06 EP disclosed