SCHEMBL2647388

SCHEMBL2647388

O=C(Nc1nccs1)C(CC1CCCC1)c1ccc(S(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 10/20 0.79
FFAR2 O15552 1/20 0.65
KCNH2 Q12809 1/20 0.63
POLB P06746 1/20 0.54
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 2/20 0.49
HSD17B10 Q99714 2/20 0.49
ALDH1A1 P00352 1/20 0.49
ACP1 P24666 1/20 0.49
MEN1 O00255 1/20 0.48
USP2 O75604 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
STAT3 P40763 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL2664673 0.90 GCK (0.74) GCKFFAR2KCNH2POLBCYP1A2
SCHEMBL2645678 0.88 GCK (0.81) GCKFFAR2KCNH2SMN1; SMN2LMNA
Ro-281675 SCHEMBL2646000 0.88 GCK (1.00) GCKFFAR2KCNH2
Ro-281675 SCHEMBL2645615 0.88 GCK (1.00) GCKFFAR2KCNH2
Ro-281675 SCHEMBL7089685 0.88 GCK (1.00) GCKFFAR2KCNH2
SCHEMBL2647740 0.88 GCK (0.71) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2647924 0.88 GCK (0.71) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL3442050 0.87 GCK (0.71) GCKFFAR2KCNH2CYP1A2CYP3A4
SCHEMBL2645004 0.87 GCK (0.98) GCKFFAR2KCNH2
SCHEMBL2646496 0.87 GCK (0.83) GCKFFAR2KCNH2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1245394-C Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE (CH) 2006-03-15 CN claimed
EP-1282611-B1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2004-10-20 EP claimed
CN-1427829-A Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE (CH) 2003-07-02 CN claimed
EP-1282611-A1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-12 EP claimed
US-6384220-B2 ANTIDIABETIC AGENTS INCREASING THE EXPRESSION OF GLUCOKINASE (GK) TO IMPROVE GLUCOSE TOLERANCE; INCREASE IN GLUCOSE EXPOSURE COUPLED THROUGH GK IN BETA-CELLS TO INCREASE INSULIN SECRETION AND IN HEPATOCYTES TO INCREASE GLYCOGEN DEPOSITION HOFFMANN-LA ROCHE INC. 2002-05-07 US claimed
US-20020002190-A1 Para-aryl or heterocyclic substituted phenyl glucokinase activators HOFFMANN-LA ROCHE INC. 2002-01-03 US claimed
WO-2001085706-A1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-15 WO claimed
CN-1245394-C Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE (CH) 2006-03-15 CN disclosed
EP-1282611-B1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2004-10-20 EP disclosed
CN-1427829-A Substituted phenylacetamides and their use as glucokinase activators HOFFMANN LA ROCHE (CH) 2003-07-02 CN disclosed
EP-1282611-A1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-12 EP disclosed
US-6384220-B2 ANTIDIABETIC AGENTS INCREASING THE EXPRESSION OF GLUCOKINASE (GK) TO IMPROVE GLUCOSE TOLERANCE; INCREASE IN GLUCOSE EXPOSURE COUPLED THROUGH GK IN BETA-CELLS TO INCREASE INSULIN SECRETION AND IN HEPATOCYTES TO INCREASE GLYCOGEN DEPOSITION HOFFMANN-LA ROCHE INC. 2002-05-07 US disclosed
US-20020002190-A1 Para-aryl or heterocyclic substituted phenyl glucokinase activators HOFFMANN-LA ROCHE INC. 2002-01-03 US disclosed
WO-2001085706-A1 SUBSTITUTED PHENYLACETAMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020002190-A1 Para-aryl or heterocyclic substituted phenyl glucokinase activators GCKR, GCK, PDXK GCK 2/4885FFAR2 940/4885KCNH2 887/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.