SCHEMBL184398

SCHEMBL184398

O=C(Nc1nc2ccc(C(O)CO)nc2s1)C(OC1CCOCC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCK P35557 15/20 0.80
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL184643 0.89 GCK (1.00) GCK
SCHEMBL184453 0.85 GCK (1.00) GCKALDH1A1KDM4EHPGDMEN1
SCHEMBL184507 0.83 GCK (0.75) GCKALDH1A1KDM4E
SCHEMBL184905 0.83 GCK (0.75) GCK
SCHEMBL627284 0.81 GCK (0.85) GCK
SCHEMBL184720 0.81 GCK (0.91) GCKALDH1A1KDM4EHPGDUSP2
SCHEMBL184038 0.79 GCK (0.68) GCKALDH1A1SMN1; SMN2
SCHEMBL19921745 0.79 GCK (0.63) GCK
SCHEMBL185316 0.77 GCK (0.79) GCK
SCHEMBL185059 0.77 GCK (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2402327-A1 Acetamide compounds as glucokinase activators, their process and medicinal applications Advinus Therapeutics Private Limited (IN) 2012-01-04 EP claimed
EP-2402327-B1 Acetamide compounds as glucokinase activators, their process and medicinal applications IMPETIS BIOSCIENCES LTD (IN) 2018-03-07 EP disclosed
EP-2402327-A1 Acetamide compounds as glucokinase activators, their process and medicinal applications Advinus Therapeutics Private Limited (IN) 2012-01-04 EP disclosed