SCHEMBL14023949

SCHEMBL14023949

Cc1cnc2nc1-c1ccnc(c1)COC/C=C/COCc1cc(ccc1N1CCN(C)CC1)N2

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 19/20 0.60
TYK2 P29597 18/20 0.60
FLT3 P36888 18/20 0.60
JAK1 P23458 14/20 0.60
JAK3 P52333 12/20 0.54
CDK2 P24941 10/20 0.54
CYP3A4 P08684 3/20 0.54
CYP2D6 P10635 2/20 0.52
CCNA2 P20248 5/20 0.50
CCNA1 P78396 5/20 0.50
ALK Q9UM73 1/20 0.41

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
SCHEMBL14023904 0.92 JAK2 (0.61) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14023902 0.90 JAK2 (0.63) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14022999 0.89 JAK2 (0.52) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14022847 0.88 JAK2 (0.70) JAK2TYK2FLT3JAK1JAK3
SCHEMBL1108261 0.87 JAK2 (0.73) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14022877 0.81 JAK2 (0.79) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14022824 0.81 JAK2 (0.71) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14023004 0.81 JAK2 (0.73) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14023944 0.81 JAK2 (0.73) JAK2TYK2FLT3JAK1JAK3
SCHEMBL14022828 0.79 JAK2 (0.61) JAK2TYK2FLT3JAK1JAK3

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-2008140419-A2 PYRIDYL SUBSTITUTED PYRIMIDINE DERIVATIVES S*BIO PTE LTD (SG) 2008-11-20 WO disclosed