SCHEMBL2369933

SCHEMBL2369933

OCCN1CCN(c2ccnc(Nc3nccc4nc(-c5c(F)cccc5Cl)[nH]c34)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 10/20 0.54
JAK2 O60674 9/20 0.54
WEE1 P30291 1/20 0.39
EGFR P00533 1/20 0.37
SRC P12931 4/20 0.37
HTR2A P28223 1/20 0.37
INSR P06213 1/20 0.36
LCK P06239 1/20 0.36
LYN P07948 1/20 0.36
KDR P35968 1/20 0.36
CDK1 P06493 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNA2 P20248 1/20 0.36
CCND1 P24385 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
PRCP P42785 1/20 0.36

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
SCHEMBL2372584 0.94 TYK2 (0.60) TYK2JAK2WEE1SRCINSR
SCHEMBL2372424 0.90 TYK2 (0.50) TYK2JAK2WEE1CDK1CDK4
SCHEMBL2371361 0.89 TYK2 (0.70) TYK2JAK2WEE1EGFRSRC
SCHEMBL2384311 0.87 TYK2 (0.51) TYK2JAK2SRCCDK2
SCHEMBL2372671 0.86 JAK2 (0.54) TYK2JAK2WEE1EGFRSRC
SCHEMBL2372126 0.86 JAK2 (0.56) TYK2JAK2WEE1EGFRSRC
SCHEMBL2372970 0.84 JAK2 (0.51) TYK2JAK2WEE1SRCCDK1
SCHEMBL2372541 0.84 JAK2 (0.60) TYK2JAK2WEE1SRC
SCHEMBL2372556 0.83 JAK2 (0.55) TYK2JAK2WEE1CDK1CDK4
SCHEMBL2371602 0.83 TYK2 (0.78) TYK2JAK2WEE1EGFRSRC

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 6/4885WEE1 1531/4885

“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.