SCHEMBL4488239

SCHEMBL4488239

CCCCCC(C)(C)Nc1c(-c2ccncc2)nc2cc(C)ccn12

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.53
MAPT P10636 5/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
KDM4E B2RXH2 4/20 0.53
GFER P55789 2/20 0.53
LMNA P02545 1/20 0.53
BACE1 P56817 1/20 0.45
ATM Q13315 3/20 0.44
TP53 P04637 3/20 0.43
ALOX5 P09917 1/20 0.43
PKM P14618 1/20 0.42
PKLR P30613 1/20 0.42
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.39
NR1H4 Q96RI1 1/20 0.39

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
Hydrochloric Acid SCHEMBL4498528 0.99 GAA (0.53) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4490250 0.90 GAA (0.55) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4492943 0.87 GAA (0.57) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4483398 0.86 SMN1; SMN2 (0.57) GAAMAPTALDH1A1SMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL4498124 0.86 GAA (0.56) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4491080 0.86 SMN1; SMN2 (0.57) GAAMAPTALDH1A1SMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL4478296 0.85 MAPT (0.56) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4484687 0.85 PKM (0.42) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL5167274 0.84 GAA (0.57) GAAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL4489731 0.84 PKM (0.42) GAAMAPTALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7592351-B2 Substituted imidazo[1,2-a]pyridine compounds and pharmaceutical preparations containing substituted imidazo[1,2-a]pyridine compounds GRUENENTHAL GMBH (DE) 2009-09-22 US claimed
US-20070099896-A1 Substituted imidazo[1,2-a]pyridine compounds and pharmaceutical preparations containing substituted imidazo[1,2-a]pyridine compounds GRUENENTHAL GMBH (DE) 2007-05-03 US claimed
EP-1756105-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AND DRUGS CONTAINING SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS Grünenthal GmbH (DE) 2007-02-28 EP claimed
WO-2005105798-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AND DRUGS CONTAINING SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS Grünenthal GmbH (DE) 2005-11-10 WO claimed
US-7592351-B2 Substituted imidazo[1,2-a]pyridine compounds and pharmaceutical preparations containing substituted imidazo[1,2-a]pyridine compounds GRUENENTHAL GMBH (DE) 2009-09-22 US disclosed
US-20070099896-A1 Substituted imidazo[1,2-a]pyridine compounds and pharmaceutical preparations containing substituted imidazo[1,2-a]pyridine compounds GRUENENTHAL GMBH (DE) 2007-05-03 US disclosed
EP-1756105-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AND DRUGS CONTAINING SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS Grünenthal GmbH (DE) 2007-02-28 EP disclosed
WO-2005105798-A1 SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AND DRUGS CONTAINING SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE COMPOUNDS Grünenthal GmbH (DE) 2005-11-10 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-20070099896-A1 Substituted imidazo[1,2-a]pyridine compounds and pharmaceutical preparations containing substituted imidazo[1,2-a]pyridine compounds GIPR, CHUK, ITPA GAA 506/4885MAPT 1958/4885ALDH1A1 515/4885

“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.