SCHEMBL1086175

SCHEMBL1086175

Cc1cccc(C)c1Nc1c(-c2ccccc2C(=O)NNC(=O)OC(C)(C)C)nc2ccc(F)cn12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.40
TP53 P04637 8/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
GAA P10253 13/20 0.39
TRPA1 O75762 1/20 0.38
POLB P06746 2/20 0.37
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LCK P06239 1/20 0.35

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
SCHEMBL13070736 0.87 MAPT (0.44) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL1086779 0.84 ALDH1A1 (0.43) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL1086546 0.84 MAPT (0.45) MAPTTP53SMN1; SMN2GAATRPA1
Hydrochloric Acid SCHEMBL1086711 0.83 MAPT (0.44) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL1087147 0.83 MAPT (0.47) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL2291215 0.77 MAPT (0.45) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL2292180 0.76 MAPT (0.42) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL2287174 0.74 GAA (0.44) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL2290103 0.74 GAA (0.43) MAPTTP53SMN1; SMN2GAATRPA1
SCHEMBL13070805 0.73 MAPT (0.41) MAPTTP53SMN1; SMN2GAATRPA1

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-8153649-B2 3-aminoimidazo 1,2-A pyridine derivatives having an SGLT1- and SGLT2-inhibiting action for the treatment of type 1 and type 2 diabetes MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-04-10 US disclosed
US-20100305142-A1 3-AMINOIMIDAZO 1,2-A PYRIDINE DERIVATIVES HAVING AN SGLT1- AND SGLT2-INHIBITING ACTION FOR THE TREATMENT OF TYPE 1 AND TYPE 2 DIABETES MERCK PATENT GESELLSCHAFT (DE) 2010-12-02 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-20100305142-A1 3-AMINOIMIDAZO 1,2-A PYRIDINE DERIVATIVES HAVING AN SGLT1- AND SGLT2-INHIBITING ACTION FOR THE TREATMENT OF TYPE 1 AND TYPE 2 DIABETES SLC5A1, SLC5A2, GLP1R MAPT 1231/4885TP53 4468/4885SMN1; SMN2 3273/4885

“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.