SCHEMBL19450

SCHEMBL19450

Clc1nccn2nc(Nc3ccc4c(c3)CCN4)nc12

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.44
PTK2 Q05397 18/20 0.44
JAK3 P52333 11/20 0.43
TYK2 P29597 1/20 0.39
WEE1 P30291 1/20 0.38

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
SCHEMBL23216 0.82 BCL6 (0.48) PTK2
SCHEMBL15221144 0.74 JAK2 (0.46) JAK2PTK2JAK3
SCHEMBL20035 0.74 JAK2 (0.51) JAK2PTK2JAK3WEE1
SCHEMBL16394337 0.74 FLT3 (0.48) JAK2PTK2JAK3
SCHEMBL21072 0.74 JAK2 (0.40) JAK2PTK2JAK3
SCHEMBL21018 0.73 NFKB1 (0.51) JAK2PTK2JAK3
SCHEMBL15210422 0.72 SYK (0.51) JAK2PTK2JAK3WEE1
SCHEMBL19266 0.72 KDR (0.48) JAK2PTK2JAK3
SCHEMBL15210382 0.72 JAK2 (0.53) JAK2PTK2JAK3
SCHEMBL15221132 0.71 PSEN1 (0.46) 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
EP-2609098-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed