SCHEMBL2965272

SCHEMBL2965272

Cc1cccc(-c2cnc3[nH][c]nc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 7/20 0.42
GRIN2B Q13224 7/20 0.42
KIT P10721 1/20 0.42
CCNT1 O60563 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK9 P50750 1/20 0.41
GAK O14976 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
IDO1 P14902 1/20 0.39
METAP2 P50579 1/20 0.39
AAK1 Q2M2I8 1/20 0.38
MAP4K4 O95819 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL2974783 0.83 CDK8 (0.47) CDK2CDK9MAP4K4
SCHEMBL2973238 0.82 HSD17B1 (0.46) METAP2MAP4K4
SCHEMBL2974909 0.82 BIRC5 (0.50) IDO1METAP2
SCHEMBL2979465 0.78 CYP2A6 (0.49) KITCCNT1CCNA2CDK2CDK9
SCHEMBL2975272 0.76 CYP1A2 (0.34)
SCHEMBL2978668 0.74 CLK1 (0.43) KITCCNT1CCNA2CDK2CDK9
SCHEMBL2981890 0.74 NPC1 (0.38) CDK2METAP2MAP4K4
SCHEMBL2981228 0.73 MAPK8 (0.45)
SCHEMBL2979016 0.71 CA12 (0.43) GRIN1GRIN2BCCNT1CCNA2CDK2
SCHEMBL2977491 0.71 RIPK1 (0.54) GRIN1GRIN2BKITGAKEGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100280002-A1 AMINOPYRIDINE-DERIVATIVES AS INDUCTIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2010-11-04 US disclosed
US-7781453-B2 Aminopyridine-derivatives ALTANA PHARMA AG (DE) 2010-08-24 US disclosed
US-20080176894-A1 Used as nitric oxide synthase inhibitors; treating acute inflammatory disease with such as 2-[2-(2-amino-4-methylpyridin-6-yl)ethyl]-3H-imidazo[4,5-b]pyridine ALTANA PHARMA AG 2008-07-24 US disclosed
EP-1675853-B1 IMIDAZO(4,5-B)PYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS NYCOMED GMBH (DE) 2008-06-18 EP disclosed
US-20080108652-A1 Imidazo (4,5-B) pyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG 2008-05-08 US disclosed
US-7329677-B2 Imidazo(4,5-b)pyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2008-02-12 US disclosed
US-7317021-B2 Aminopyridine-derivatives as inductible no-synthase inhibitors ALTANA PHARMA AG (DE) 2008-01-08 US disclosed
US-20070043072-A1 Aminopyridine-derivatives as inductible no-synthase inhibitors ALTANA PHARMA AG (DE) 2007-02-22 US disclosed
US-20070010549-A1 Imidazo(4,5-b)pyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2007-01-11 US disclosed
EP-1675853-A1 IMIDAZO(4,5-B)PYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA Pharma AG (DE) 2006-07-05 EP disclosed
EP-1670798-A1 AMINOPYRIDINE-DERIVATIVES AS INDUCTIBLE NO-SYNTHASE INHIBITORS Altana Pharma AG (DE) 2006-06-21 EP disclosed
WO-2005061496-A1 AMINOPYRIDINE-DERIVATIVES AS INDUCTIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2005-07-07 WO disclosed
WO-2005030768-A1 IMIDAZO(4,5-B)PYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2005-04-07 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 (5 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-20070043072-A1 Aminopyridine-derivatives as inductible no-synthase inhibitors NOS2, NOS1, NOS3 GRIN1 468/4885GRIN2B 495/4885KIT 1744/4885
US-20100280002-A1 AMINOPYRIDINE-DERIVATIVES AS INDUCTIBLE NO-SYNTHASE INHIBITORS NOS2, NOS1, NOS3 GRIN1 468/4885GRIN2B 495/4885KIT 1744/4885
US-20080108652-A1 Imidazo (4,5-B) pyridine-derivatives as inducible no-synthase inhibitors NOS2, NOS1, NOS3 GRIN1 1086/4885GRIN2B 1304/4885KIT 1727/4885
US-20080176894-A1 Used as nitric oxide synthase inhibitors; treating acute inflammatory disease with such as 2-[2-(2-amino-4-methylpyridin-6-yl)ethyl]-3H-imidazo[4,5-b]pyridine NOS2, NOS1, NOS3 GRIN1 623/4885GRIN2B 607/4885KIT 2501/4885
US-20070010549-A1 Imidazo(4,5-b)pyridine-derivatives as inducible no-synthase inhibitors NOS2, NOS1, NOS3 GRIN1 1086/4885GRIN2B 1304/4885KIT 1727/4885

“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.