SCHEMBL2293465

SCHEMBL2293465

Cc1cccc(C)c1Nc1c(-c2c(NCCN)cccc2OCC(N)=O)nc2ccc(F)cn12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.40
GAA P10253 10/20 0.39
MAPT P10636 8/20 0.38
TP53 P04637 6/20 0.37
SMN1; SMN2 Q16637 3/20 0.34
MAPK1 P28482 2/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SYK P43405 1/20 0.34
POLB P06746 1/20 0.34
QPCT Q16769 1/20 0.34
PLAU P00749 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL2289468 0.94 TRPA1 (0.40) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2290007 0.93 TRPA1 (0.39) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2289531 0.92 TRPA1 (0.41) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2291629 0.90 TRPA1 (0.43) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2292541 0.90 MAPT (0.37) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2295293 0.89 GAA (0.42) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2287277 0.89 GAA (0.47) GAAMAPTTP53SMN1; SMN2MAPK1
SCHEMBL2289507 0.87 TRPA1 (0.41) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2289522 0.87 TRPA1 (0.41) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2292148 0.87 TRPA1 (0.43) TRPA1GAAMAPTTP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2032571-B1 3 -AMINO-IMIDAZO[1, 2-A]PYRIDINE DERIVATIVES AS SGLT INHIBITORS MERCK PATENT GMBH (DE) 2014-12-03 EP claimed
EP-2032571-B1 3 -AMINO-IMIDAZO[1, 2-A]PYRIDINE DERIVATIVES AS SGLT INHIBITORS MERCK PATENT GMBH (DE) 2014-12-03 EP disclosed
US-8258151-B2 3-aminoimidazo [1,2-A] pyridine derivatives as SGLT inhibitors MERCK PATENT GMBH (DE) 2012-09-04 US disclosed
US-20110195991-A1 3-AMINOIMIDAZO [1,2-A] PYRIDINE DERIVATIVES AS SGLT INHIBITORS MERCK PATENT GESELLSCHAFT (DE) 2011-08-11 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-20110195991-A1 3-AMINOIMIDAZO [1,2-A] PYRIDINE DERIVATIVES AS SGLT INHIBITORS GLP1R, SLC5A1, SLC5A2 TRPA1 1229/4885GAA 1202/4885MAPT 1138/4885

“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.