SCHEMBL12296293

SCHEMBL12296293

O=C(c1cc(Nc2nccc3nc(-c4c(Cl)cccc4Cl)[nH]c23)ncn1)N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.53
TYK2 P29597 14/20 0.53
EGFR P00533 1/20 0.38
HTR2C P28335 2/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
KMT2A Q03164 1/20 0.37
GRM5 P41594 1/20 0.37

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
SCHEMBL2383014 0.94 TYK2 (0.48) JAK2TYK2EGFRHTR2C
SCHEMBL2386585 0.87 JAK2 (0.44) JAK2TYK2HTR2CCNR1CNR2
SCHEMBL2372011 0.85 TYK2 (0.52) JAK2TYK2
SCHEMBL2386132 0.84 TYK2 (0.75) JAK2TYK2KMT2A
SCHEMBL793036 0.82 TYK2 (0.55) JAK2TYK2EGFRHTR2C
SCHEMBL2372788 0.82 JAK2 (0.55) JAK2TYK2
SCHEMBL12295644 0.81 TYK2 (0.47) JAK2TYK2
SCHEMBL2386562 0.80 JAK2 (0.56) JAK2TYK2
SCHEMBL2372405 0.79 TYK2 (0.46) JAK2TYK2
SCHEMBL2372938 0.79 TYK2 (0.59) JAK2TYK2

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 4 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
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 1/4885EGFR 1005/4885

“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.