SCHEMBL2640495

SCHEMBL2640495

CN1CCN(c2cccc(Nc3nc4c(N)cccn4n3)c2)CC1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.69
PTK2 Q05397 20/20 0.69
JAK3 P52333 14/20 0.69
ABCB1 P08183 1/20 0.65
CYP3A4 P08684 1/20 0.65
JAK1 P23458 1/20 0.65

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
SCHEMBL15416863 0.88 JAK2 (0.77) JAK2PTK2JAK3JAK1
SCHEMBL12973810 0.84 JAK2 (0.79) JAK2PTK2JAK3
SCHEMBL2634844 0.82 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2634797 0.81 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2640307 0.80 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2640506 0.80 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2634830 0.80 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2640433 0.80 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL2634896 0.79 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4
SCHEMBL30925315 0.79 JAK2 (1.00) JAK2PTK2JAK3ABCB1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2438066-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a]PYRIDINE DERIVATIVES Cephalon, Inc. (US) 2012-04-11 EP claimed
WO-2010141796-A2 PREPARATION AND USES OF 1,2,4-TRIAZOLO [1,5a] PYRIDINE DERIVATIVES CEPHALON, INC. (US) 2010-12-09 WO claimed
US-8633173-B2 Preparation and uses of 1,2,4-triazolo [1,5a] pyridine derivatives CEPHALON, INC (US) 2014-01-21 US disclosed