SCHEMBL2371499

SCHEMBL2371499

CN1CCN(c2cc(Nc3nccc4nc(-c5c(Cl)cccc5Cl)[nH]c34)ncn2)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 16/20 0.62
JAK2 O60674 15/20 0.62
CYP1A2 P05177 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP2C19 P33261 1/20 0.42
ABL1 P00519 1/20 0.41
HRH4 Q9H3N8 2/20 0.41
JAK1 P23458 1/20 0.40
CDK2 P24941 1/20 0.40
CDK9 P50750 1/20 0.40
JAK3 P52333 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
SCHEMBL2371870 0.94 TYK2 (0.56) TYK2JAK2CYP1A2ALOX15CYP2C19
SCHEMBL12294719 0.92 TYK2 (0.73) TYK2JAK2JAK1CDK2CDK9
SCHEMBL12295383 0.92 TYK2 (0.70) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2371829 0.91 TYK2 (0.72) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2371791 0.90 JAK2 (0.55) TYK2JAK2CYP1A2ALOX15CYP2C19
SCHEMBL2371602 0.90 TYK2 (0.78) TYK2JAK2ABL1JAK3
SCHEMBL12294996 0.89 TYK2 (0.60) TYK2JAK2JAK1CDK2CDK9
SCHEMBL2386132 0.89 TYK2 (0.75) TYK2JAK2ABL1
SCHEMBL2372211 0.88 TYK2 (0.75) TYK2JAK2JAK1CDK2CDK9
SCHEMBL14858238 0.87 TYK2 (0.57) TYK2JAK2CYP1A2ALOX15CYP2C19

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 1/4885JAK2 6/4885CYP1A2 831/4885

“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.