SCHEMBL2296176

SCHEMBL2296176

Cc1cc(C)c(Nc2c(-c3ccccc3OCC(N)=O)nc3ccc(F)cn23)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.41
MAPT P10636 8/20 0.40
GAA P10253 7/20 0.40
TP53 P04637 7/20 0.40
POLB P06746 3/20 0.40
NR1H4 Q96RI1 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
KCNN4 O15554 1/20 0.38
ADORA1 P30542 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL2291110 0.95 TRPA1 (0.42) TRPA1MAPTGAATP53POLB
SCHEMBL2287174 0.93 GAA (0.44) TRPA1MAPTGAATP53POLB
SCHEMBL2290803 0.88 TRPA1 (0.42) TRPA1MAPTGAATP53POLB
SCHEMBL2292520 0.88 GAA (0.45) MAPTGAATP53SMN1; SMN2KDM4E
SCHEMBL2290086 0.88 GAA (0.43) TRPA1MAPTGAATP53POLB
SCHEMBL2288165 0.88 MAPT (0.47) TRPA1MAPTGAATP53POLB
SCHEMBL2287600 0.88 TRPA1 (0.45) TRPA1MAPTGAATP53POLB
SCHEMBL2289236 0.88 TRPA1 (0.45) TRPA1MAPTGAATP53POLB
SCHEMBL2292024 0.87 TRPA1 (0.43) TRPA1MAPTGAATP53POLB
SCHEMBL2293756 0.86 MAPT (0.44) MAPTGAATP53SMN1; SMN2KCNN4

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

“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.