SCHEMBL9899362

SCHEMBL9899362

COCC(C)Oc1ccc(Oc2ccc(-c3nnc(C)o3)cc2)cc1C(=O)Nc1nccs1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.53
KCNH2 Q12809 2/20 0.53
KCNMA1 Q12791 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 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
SCHEMBL9898644 0.94 GCK (0.54) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL2726680 0.94 GCK (0.54) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL9898775 0.87 GCK (0.70) GCKKCNH2
SCHEMBL2724721 0.87 GCK (0.70) GCKKCNH2
SCHEMBL9897930 0.87 GCK (0.70) GCKKCNH2
SCHEMBL9898171 0.86 GCK (0.53) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL2708202 0.85 GCK (0.53) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL9900415 0.85 GCK (0.53) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL9898608 0.83 GCK (0.51) GCKKCNH2KCNMA1NPC1RAB9A
SCHEMBL1271326 0.83 NR1H4 (0.43) GCKGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8450494-B2 Disubstituted benzamide derivatives as glucokinase (GK) activators CADILA HEALTHCARE LIMITED (IN) 2013-05-28 US disclosed
US-20120149704-A1 DISUBSTITUTED BENZAMIDE DERIVATIVES AS GLUCOKINASE (GK) ACTIVATORS CADILA HEALTHCARE LIMITED (IN) 2012-06-14 US 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-20120149704-A1 DISUBSTITUTED BENZAMIDE DERIVATIVES AS GLUCOKINASE (GK) ACTIVATORS GCKR, GCK, GK GCK 2/4885KCNH2 256/4885KCNMA1 637/4885

“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.