SCHEMBL15428958

SCHEMBL15428958

COc1cc(Cl)ccc1-c1cccn2nc(Nc3ccc4c(c3)CCC(NC(=O)N(C)C)CC4)nc12

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.72
PTK2 Q05397 20/20 0.72
JAK3 P52333 14/20 0.72

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
SCHEMBL15428957 0.91 JAK2 (0.72) JAK2PTK2JAK3
SCHEMBL3764437 0.84 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL2634312 0.81 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL15428959 0.79 JAK2 (0.74) JAK2PTK2JAK3
SCHEMBL2640561 0.79 JAK2 (0.70) JAK2PTK2JAK3
SCHEMBL2634737 0.76 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL2640525 0.75 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL2640566 0.75 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL2634356 0.75 JAK2 (1.00) JAK2PTK2JAK3
SCHEMBL3770418 0.74 JAK2 (0.74) JAK2PTK2JAK3

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