SCHEMBL3545664

SCHEMBL3545664

CCOC(=O)c1cn2c(C)c(N)ccc2n1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.63
KDM4E B2RXH2 7/20 0.51
POLB P06746 2/20 0.51
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
RXFP1 Q9HBX9 1/20 0.48
KMT2A Q03164 3/20 0.47
CYP1A2 P05177 1/20 0.46
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 2/20 0.43

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
SCHEMBL117177 0.83 GAA (0.63) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL21356112 0.83 GAA (0.63) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL3542064 0.81 GAA (0.60) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL3369735 0.81 PTGS1 (0.41) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL3033258 0.81 GAA (0.75) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL21354875 0.79 GAA (0.61) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL118187 0.78 GAA (0.75) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL3545619 0.77 KDM4E (0.64) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL101291 0.77 GAA (1.00) GAAKDM4EPOLBRAB9ANPC1
SCHEMBL3499867 0.77 GABRA2 (0.57) GAAKDM4EPOLBRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404848-B2 Derivatives of imidazo[1,2-a]pyridine-2-carboxamides, preparation method thereof and use of same in therapeutics SANOFI (FR) 2013-03-26 US disclosed
US-7704989-B2 Derivatives of imidazo[1,2-a]pyridine-2-carboxamides, preparation method thereof and use of same in therapeutics SANOFI-AVENTIS (FR) 2010-04-27 US disclosed
US-20090149441-A1 DERIVATIVES OF IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-06-11 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-20090149441-A1 DERIVATIVES OF IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDES, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS NR4A2, NR4A3, NCOR1 GAA 4805/4885KDM4E 2303/4885POLB 3617/4885

“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.