SCHEMBL2972199

SCHEMBL2972199

CN(C)c1ccc(-c2cnc(N)c([N+](=O)[O-])c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
INPPL1 O15357 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
DHFR P00374 1/20 0.41
PDGFRB P09619 3/20 0.41
PDGFRA P16234 2/20 0.41
FYN P06241 2/20 0.40
ADK P55263 2/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CHEK1 O14757 1/20 0.40
AURKA O14965 1/20 0.40
JAK2 O60674 1/20 0.40
ABL1 P00519 1/20 0.40

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
SCHEMBL2979098 0.84 MAP4K4 (0.49) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL2981349 0.81 INPPL1 (0.57) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL1582196 0.81 MAP4K4 (0.49) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL5034039 0.81 MAPT (0.46) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL710165 0.80 CRHBP (0.53) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL11224806 0.79 INPPL1 (0.49) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL2972043 0.78 PDGFRB (0.49) MAPTMEN1KMT2ATDP1LMNA
SCHEMBL5036448 0.75 DHFR (0.54) MAPTINPPL1MEN1KMT2ATDP1
SCHEMBL10008911 0.75 MAP4K4 (0.54) MAPTMEN1KMT2ATDP1POLB
SCHEMBL6311840 0.73 MAPT (0.50) MAPTMEN1KMT2ATDP1POLB

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 9 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
CN-100415746-C Aminopyridine derivatives as inducible NO-synthase inhibitors ALTANA PHARMA AG (DE) 2008-09-03 CN 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
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
CN-1856493-A Aminopyridine derivatives as inducible NO-synthase inhibitors ALTANA PHARMA AG (DE) 2006-11-01 CN 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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 MAPT 3074/4885INPPL1 2543/4885MEN1 4279/4885
US-20100280002-A1 AMINOPYRIDINE-DERIVATIVES AS INDUCTIBLE NO-SYNTHASE INHIBITORS NOS2, NOS1, NOS3 MAPT 3074/4885INPPL1 2543/4885MEN1 4279/4885
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 MAPT 4149/4885INPPL1 1506/4885MEN1 4689/4885

“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.