SCHEMBL12295222

SCHEMBL12295222

Nc1cnc(Nc2ncnc3nc(-c4c(Cl)cccc4Cl)[nH]c23)cn1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 12/20 0.47
▸ TYK2 P29597 12/20 0.47
▸ GSK3B P49841 3/20 0.44
▸ PI4KA P42356 3/20 0.38
▸ PI4K2B Q8TCG2 3/20 0.38
▸ PI4K2A Q9BTU6 3/20 0.38
▸ PI4KB Q9UBF8 3/20 0.38
▸ CSF1R P07333 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
SCHEMBL2372437 0.87 JAK2 (0.47) JAK2TYK2GSK3BCSF1R
SCHEMBL2372127 0.86 TYK2 (0.63) JAK2TYK2GSK3B
SCHEMBL2372641 0.86 JAK2 (0.49) JAK2TYK2GSK3BPI4KAPI4K2B
SCHEMBL2372153 0.84 CHEK1 (0.48) JAK2TYK2GSK3B
SCHEMBL2372387 0.83 JAK2 (0.45) JAK2TYK2GSK3BCSF1R
SCHEMBL2372667 0.82 JAK2 (0.44) JAK2TYK2GSK3BCSF1R
SCHEMBL2371831 0.82 JAK2 (0.41) JAK2TYK2GSK3BCSF1R
SCHEMBL2372281 0.81 TYK2 (0.51) JAK2TYK2GSK3BCSF1R
SCHEMBL2371230 0.81 GSK3B (0.51) JAK2TYK2GSK3B
SCHEMBL2372379 0.80 PTGES (0.42) JAK2TYK2GSK3B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011113802-A2 IMIDAZOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2011-09-22 — — WO disclosed
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