SCHEMBL1097428

SCHEMBL1097428

CNc1nnc(-c2cc(Cl)ccc2-c2nc3ccc(F)cn3c2Nc2c(Cl)cccc2Cl)o1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 8/20 0.43
TP53 P04637 5/20 0.43
PKLR P30613 3/20 0.40
MAPT P10636 4/20 0.40
POLB P06746 1/20 0.40
TRPA1 O75762 3/20 0.36
ALOX15 P16050 1/20 0.35
PKM P14618 2/20 0.35
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GABRD O14764 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRA4 P48169 1/20 0.34
SLC2A2 P11168 1/20 0.34

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
SCHEMBL1097777 0.92 GAA (0.47) GAATP53PKLRMAPTPOLB
SCHEMBL1097353 0.90 GAA (0.40) GAATP53PKLRMAPTPOLB
SCHEMBL1097401 0.83 GAA (0.43) GAATP53PKLRMAPTPOLB
SCHEMBL1086502 0.81 GAA (0.45) GAATP53PKLRMAPTPOLB
SCHEMBL1097354 0.79 GAA (0.41) GAATP53PKLRMAPTPOLB
SCHEMBL1097323 0.77 PKM (0.36) GAATP53PKLRMAPTPOLB
SCHEMBL1097350 0.76 GAA (0.38) GAATP53PKLRMAPTPOLB
SCHEMBL1097755 0.72 GAA (0.43) GAATP53PKLRMAPTPOLB
SCHEMBL2809753 0.70 GAA (0.50) GAATP53MAPTALOX15PKM
SCHEMBL2812288 0.70 GAA (0.45) GAATP53MAPTALOX15PKM

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 6 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-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
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
EP-2097411-B1 3 -AMINO-IMIDAZO [1,2 -A]PYRIDINE DERIVATIVES HAVING AN SGLT1 AND SGLT2 INHIBITING ACTION, FOR TREATING TYPE 1 AND TYPE 2 DIABETES MERCK PATENT GMBH (DE) 2010-11-17 EP disclosed
WO-2008046497-A1 3 -AMINO-IMIDAZO [1,2 -A] PYRIDINE DERIVATIVES HAVING AN SGLT1 AND SGLT2 INHIBITING ACTION, FOR TREATING TYPE 1 AND TYPE 2 DIABETES MERCK PATENT GMBH (DE) 2008-04-24 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-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 GAA 2135/4885TP53 4468/4885PKLR 1649/4885

“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.