SCHEMBL2290260

SCHEMBL2290260

Cc1cccc(C)c1Nc1c(-c2c(C)cc(OC(N)C=O)cc2OCC(N)=O)nc2ccc(F)cn12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.37
GAA P10253 12/20 0.35
MAPT P10636 10/20 0.35
TP53 P04637 5/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
THRB P10828 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
POLB P06746 1/20 0.30
PLAU P00749 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
SCHEMBL2287230 0.94 GAA (0.38) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2290253 0.90 TRPA1 (0.41) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2292842 0.89 MAPT (0.44) GAAMAPTTP53SMN1; SMN2MAPK1
SCHEMBL2289183 0.89 TRPA1 (0.42) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2295451 0.87 TRPA1 (0.37) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2291220 0.86 TRPA1 (0.42) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2287514 0.86 TRPA1 (0.41) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2290031 0.86 TRPA1 (0.42) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2291629 0.86 TRPA1 (0.43) TRPA1GAAMAPTTP53SMN1; SMN2
SCHEMBL2290061 0.86 TRPA1 (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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.