SCHEMBL4489327

SCHEMBL4489327

Cc1ccn2c(NC(C)(C)CC(C)(C)C)c(-c3ccoc3)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
POLB P06746 2/20 0.48
TP53 P04637 2/20 0.48
CREBBP Q92793 3/20 0.46
PKM P14618 1/20 0.45
PKLR P30613 1/20 0.45
GAA P10253 5/20 0.45
ALDH1A1 P00352 5/20 0.45
GFER P55789 3/20 0.45
KDM4E B2RXH2 3/20 0.45
NR1H4 Q96RI1 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
BACE1 P56817 1/20 0.42
BRD4 O60885 1/20 0.42
IDO1 P14902 1/20 0.41
ALOX5 P09917 1/20 0.41
LMNA P02545 1/20 0.40
CDK9 P50750 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 SCHEMBL4493657 0.99 MAPT (0.47) MAPTPOLBTP53CREBBPPKM
SCHEMBL4484687 0.85 PKM (0.42) MAPTTP53PKMPKLRGAA
SCHEMBL4487879 0.85 ADRA1B (0.55) MAPTPOLBTP53PKMGAA
SCHEMBL5167601 0.85 MAPT (0.61) MAPTPOLBTP53CREBBPPKM
Hydrochloric Acid SCHEMBL4484479 0.85 PKM (0.42) MAPTTP53PKMPKLRGAA
SCHEMBL4484464 0.85 PKM (0.42) MAPTTP53PKMPKLRGAA
SCHEMBL4489731 0.85 PKM (0.42) MAPTTP53PKMPKLRGAA
Hydrochloric Acid SCHEMBL4496609 0.84 ADRA1B (0.54) MAPTPOLBTP53PKMGAA
Hydrochloric Acid SCHEMBL4500761 0.84 PKM (0.41) MAPTTP53PKMPKLRGAA
Hydrochloric Acid SCHEMBL4496610 0.84 PKM (0.41) MAPTTP53PKMPKLRGAA

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 MAPT 1958/4885POLB 3757/4885TP53 456/4885

“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.