SCHEMBL1107510

SCHEMBL1107510

CCOC(=O)/C(CC(=O)C(C)(C)C)=N/OC

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
KYAT1 Q16773 5/20 0.32
ALDH1A1 P00352 6/20 0.32
CYP2D6 P10635 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GLO1 Q04760 1/20 0.32
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL950646 0.84 MAPT (0.43) MAPTGAAMGAMSIMGAM2
SCHEMBL950647 0.84 MAPT (0.43) MAPTGAAMGAMSIMGAM2
SCHEMBL14487036 0.84 MAPT (0.43) MAPTGAAMGAMSIMGAM2
SCHEMBL2668995 0.81 MAPT (0.37) MAPTGAAMGAMSIMGAM2
SCHEMBL15100755 0.79 MAPT (0.38) MAPTGAAMGAMSIMGAM2
SCHEMBL20778292 0.79 MAPT (0.38) MAPTGAAMGAMSIMGAM2
SCHEMBL29134126 0.79 MAPT (0.38) MAPTGAAMGAMSIMGAM2
SCHEMBL951120 0.76 MAPT (0.36) MAPTGAAMGAMSIMGAM2
SCHEMBL951119 0.76 MAPT (0.36) MAPTGAAMGAMSIMGAM2
SCHEMBL5221727 0.74 ALDH1A1 (0.45) MAPTGAAMGAMSIMGAM2

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-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, MPO, GCK MAPT 4710/4885GAA 750/4885MGAM 30/4885

“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.