SCHEMBL2371998

SCHEMBL2371998

Nc1ncncc1Nc1ncnc2nc(-c3c(Cl)cccc3Cl)[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.43
PI4KA P42356 3/20 0.41
PI4K2B Q8TCG2 3/20 0.41
PI4K2A Q9BTU6 3/20 0.41
PI4KB Q9UBF8 3/20 0.41
JAK2 O60674 7/20 0.40
TYK2 P29597 7/20 0.40
EGFR P00533 2/20 0.37
CSF1R P07333 1/20 0.36
TTBK1 Q5TCY1 1/20 0.34
TTBK2 Q6IQ55 1/20 0.34
PRMT5 O14744 1/20 0.34
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL2372185 0.80 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBJAK2
SCHEMBL12295222 0.79 JAK2 (0.47) GSK3BPI4KAPI4K2BPI4K2API4KB
SCHEMBL2382873 0.79 LMNA (0.50) GSK3BPI4KAPI4K2BPI4K2API4KB
SCHEMBL2372127 0.79 TYK2 (0.63) GSK3BJAK2TYK2
SCHEMBL2372641 0.79 JAK2 (0.49) GSK3BPI4KAPI4K2BPI4K2API4KB
SCHEMBL2372387 0.78 JAK2 (0.45) GSK3BJAK2TYK2CSF1R
SCHEMBL2371959 0.76 JAK2 (0.46) GSK3BPI4KAPI4K2BPI4K2API4KB
SCHEMBL2371592 0.76 JAK2 (0.52) GSK3BJAK2TYK2EGFRTSHR
SCHEMBL2372281 0.76 TYK2 (0.51) GSK3BJAK2TYK2CSF1R
SCHEMBL2372667 0.75 JAK2 (0.44) GSK3BJAK2TYK2CSF1RTSHR

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 GSK3B 332/4885PI4KA 83/4885PI4K2B 74/4885

“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.