SCHEMBL2867747

SCHEMBL2867747

NS(=O)(=O)c1cc(Cl)c(Nc2nc3ccc(F)cc3c3c2=CC(=O)[N]C=3)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.46
EGFR P00533 2/20 0.34
KDR P35968 2/20 0.34
NTRK1 P04629 2/20 0.31
CA1 P00915 4/20 0.31
CA2 P00918 4/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 3/20 0.31
PYGL P06737 2/20 0.31
CA12 O43570 2/20 0.30
PLK1 P53350 1/20 0.30
SOS1 Q07889 2/20 0.30

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
SCHEMBL2858032 0.88 JAK2 (0.44) JAK2EGFRKDRCA1CA2
SCHEMBL2867090 0.84 JAK2 (0.34) JAK2CA1CA2
SCHEMBL2856300 0.82 TDO2 (0.37) JAK2CA1CA2
SCHEMBL2865418 0.81 SRC (0.39) KDR
SCHEMBL3501611 0.75 JAK2 (0.74) JAK2
SCHEMBL2859344 0.67 MAPT (0.43)
SCHEMBL2862232 0.65 JAK2 (0.73) JAK2
SCHEMBL2856662 0.63 SRC (0.32) KDR
SCHEMBL3502112 0.63 JAK2 (1.00) JAK2
SCHEMBL13249650 0.62 JAK2 (0.67) JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2200612-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-06-30 EP claimed
WO-2009035575-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2009-03-19 WO claimed
EP-2200612-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-06-30 EP disclosed
WO-2009035575-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2009-03-19 WO disclosed