SCHEMBL2371779

SCHEMBL2371779

Clc1cccc(Br)c1-c1nc2ccnc(Nc3ccncn3)c2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 16/20 0.60
TYK2 P29597 16/20 0.60
JAK1 P23458 1/20 0.36
PTGES O14684 2/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CCNA1 P78396 1/20 0.34
KDR P35968 1/20 0.34

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
SCHEMBL12295360 0.88 JAK2 (0.60) JAK2TYK2PTGES
SCHEMBL14858365 0.88 JAK2 (0.47) JAK2TYK2PTGES
SCHEMBL2383138 0.84 JAK2 (0.56) JAK2TYK2JAK1CCNA2CDK2
SCHEMBL2371815 0.83 TYK2 (0.53) JAK2TYK2JAK1PTGESCCNA2
SCHEMBL2372938 0.79 TYK2 (0.59) JAK2TYK2JAK1CDK2KDR
SCHEMBL2371810 0.78 JAK2 (0.48) JAK2TYK2KDR
SCHEMBL2371216 0.78 TYK2 (0.70) JAK2TYK2JAK1CDK2KDR
SCHEMBL2372898 0.78 TYK2 (0.72) JAK2TYK2JAK1CDK2KDR
SCHEMBL2372568 0.77 TYK2 (0.48) JAK2TYK2JAK1KDR
SCHEMBL2372465 0.77 TYK2 (0.69) JAK2TYK2KDR

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 5 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

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 JAK2 6/4885TYK2 1/4885JAK1 7/4885

“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.