SCHEMBL16626464

SCHEMBL16626464

CNCc1cn([S+]([O-])c2cccnc2)c2cc(Nc3cccnc3OC)ccc12

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.35
LRRK2 Q5S007 1/20 0.35
VDR P11473 1/20 0.34
GRM4 Q14833 2/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
PTK2 Q05397 1/20 0.32
JAK1 P23458 1/20 0.30
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 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
SCHEMBL16626707 0.90 PTK6 (0.30)
SCHEMBL16626457 0.90 PARP14 (0.33) GRM4
SCHEMBL16626726 0.89 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL16626468 0.88 METAP2 (0.30)
SCHEMBL16626370 0.85 MAPK8 (0.35) NAMPT
SCHEMBL16626484 0.83 BCL6 (0.36)
SCHEMBL16626730 0.83 EGFR (0.38) NAMPTGRM4JAK2JAK3PTK2
SCHEMBL16626715 0.83 GRM4 (0.33) GRM4
SCHEMBL16626476 0.83
SCHEMBL19984004 0.83 MEN1 (0.32) NAMPT

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-2015050412-A1 SULFONYLINDOLE DERIVATIVES AND METHOD FOR PREPARING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2015-04-09 WO disclosed