SCHEMBL2816809

SCHEMBL2816809

Cc1cc(C)n2c(Nc3c(C)cccc3C)c(-c3ccccc3OCC(N)=O)nc2n1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 11/20 0.53
MAPT P10636 7/20 0.53
TP53 P04637 5/20 0.52
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.41
ADORA1 P30542 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KCNN4 O15554 1/20 0.36
CASP1 P29466 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL2292943 0.87 SMN1; SMN2 (0.61) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2293410 0.85 MAPT (0.48) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2293586 0.83 MAPT (0.53) GAAMAPTTP53SMN1; SMN2ADORA1
SCHEMBL2290049 0.83 MAPT (0.48) GAAMAPTTP53SMN1; SMN2ADORA1
SCHEMBL2810374 0.81 GAA (0.66) GAAMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2288504 0.81 GAA (0.54) GAAMAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL2294046 0.81 SMN1; SMN2 (0.53) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2288371 0.79 MAPT (0.46) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2289678 0.79 GAA (0.54) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2287174 0.79 GAA (0.44) GAAMAPTTP53POLBSMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2195322-B1 IMIDAZO[1,2-A]PYRIMIDINE DERIVATIVES FOR TREATING DISEASES SUCH AS DIABETES MERCK PATENT GMBH (DE) 2014-08-06 EP claimed
US-8278312-B2 Imidazo 1,2-a pyrimidine derivatives for the treatment of diseases such as diabetes MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2012-10-02 US claimed
US-20100249151-A1 IMIDAZO 1, 2-A PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS DIABETES Merck Patent Gesellschaft Beschrankter Haftung (DE) 2010-09-30 US claimed
EP-2195322-B1 IMIDAZO[1,2-A]PYRIMIDINE DERIVATIVES FOR TREATING DISEASES SUCH AS DIABETES MERCK PATENT GMBH (DE) 2014-08-06 EP disclosed
EP-2195322-B1 IMIDAZO[1,2-A]PYRIMIDINE DERIVATIVES FOR TREATING DISEASES SUCH AS DIABETES MERCK PATENT GMBH (DE) 2014-08-06 EP disclosed
US-8278312-B2 Imidazo 1,2-a pyrimidine derivatives for the treatment of diseases such as diabetes MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2012-10-02 US disclosed
US-8278312-B2 Imidazo 1,2-a pyrimidine derivatives for the treatment of diseases such as diabetes MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2012-10-02 US disclosed
US-20100249151-A1 IMIDAZO 1, 2-A PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS DIABETES Merck Patent Gesellschaft Beschrankter Haftung (DE) 2010-09-30 US disclosed
US-20100249151-A1 IMIDAZO 1, 2-A PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS DIABETES Merck Patent Gesellschaft Beschrankter Haftung (DE) 2010-09-30 US disclosed
WO-2009049731-A1 IMIDAZO[1,2-A]PYRIMIDINE DERIVATIVES FOR TREATING DISEASES SUCH AS DIABETES MERCK PATENT GMBH (DE) 2009-04-23 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-20100249151-A1 IMIDAZO 1, 2-A PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS DIABETES TYMS, CCNT1, INSR GAA 1202/4885MAPT 3889/4885TP53 1417/4885

“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.