SCHEMBL15416792

SCHEMBL15416792

O=C(O)N1CCC(c2ccc(Nc3nc4c(-c5ccc(F)cc5)cccn4n3)cc2)CC1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.77
JAK3 P52333 20/20 0.77
PTK2 Q05397 20/20 0.77

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
SCHEMBL2634207 0.87 JAK3 (1.00) JAK2JAK3PTK2
SCHEMBL15416892 0.85 JAK3 (0.81) JAK2JAK3PTK2
SCHEMBL2634719 0.84 JAK2 (1.00) JAK2JAK3PTK2
SCHEMBL2634735 0.84 JAK3 (1.00) JAK2JAK3PTK2
SCHEMBL15416874 0.82 JAK3 (0.81) JAK2JAK3PTK2
SCHEMBL15416791 0.81 JAK3 (0.82) JAK2JAK3PTK2
SCHEMBL3213421 0.80 JAK2 (0.76) JAK2JAK3PTK2
SCHEMBL15416893 0.80 JAK3 (0.81) JAK2JAK3PTK2
SCHEMBL3760028 0.79 JAK3 (0.82) JAK2JAK3PTK2
SCHEMBL12973798 0.79 JAK3 (0.85) JAK2JAK3PTK2

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
US-8633173-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC (US) 2014-01-21 US disclosed