SCHEMBL2372638

SCHEMBL2372638

Cc1cc(Nc2nccc3nc(-c4ccccc4OC(F)(F)F)[nH]c23)nc(C)n1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.45
POLB P06746 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PDE10A Q9Y233 1/20 0.39
GAA P10253 1/20 0.36
EGFR P00533 1/20 0.34
S1PR1 P21453 1/20 0.34
PDE5A O76074 2/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
SCN9A Q15858 4/20 0.33
KIT P10721 1/20 0.33
ABL1 P00519 1/20 0.33
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
RPS6KA2 Q15349 1/20 0.33
TRPA1 O75762 1/20 0.32

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
SCHEMBL12296265 0.85 TYK2 (0.47) TYK2POLBGAATRPA1
SCHEMBL2372988 0.82 TYK2 (0.62) TYK2POLBGAA
SCHEMBL2371051 0.79 TYK2 (0.41) TYK2POLBGAACDK9
SCHEMBL12295612 0.78 TYK2 (0.45) TYK2POLBGAAEGFRKIT
SCHEMBL2372121 0.77 TYK2 (0.43) TYK2POLBGAACDK9
SCHEMBL14869050 0.76 TYK2 (0.39) TYK2POLBGAAEGFRKIT
SCHEMBL12294563 0.75 TYK2 (0.55) TYK2POLBGAACDK9
SCHEMBL12295626 0.74 TYK2 (0.48) TYK2POLBGAACDK9
SCHEMBL2371706 0.73 TYK2 (0.48) TYK2
SCHEMBL12294570 0.72 TYK2 (0.47) TYK2POLBGAACDK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
US-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE GENENTECH, INC. (US) 2013-04-18 US disclosed
EP-2547338-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2013-01-23 EP disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 WO disclosed
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 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-20130096104-A1 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE TYK2, IRAK1, IRAK4 TYK2 1/4885POLB 1289/4885NPSR1 2469/4885

“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.