SCHEMBL27798484

SCHEMBL27798484

NC(=O)C(C(N)=S)(c1ccccc1)c1ccc(F)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 14/20 0.64
KCNE1 P15382 1/20 0.54
KCNQ1 P51787 1/20 0.54
KIF11 P52732 2/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
PLK4 O00444 1/20 0.41
DAPK3 O43293 1/20 0.41
RPS6KA5 O75582 1/20 0.41
MAP4K4 O95819 1/20 0.41
ERBB2 P04626 1/20 0.41
PRKCG P05129 1/20 0.41
PIM1 P11309 1/20 0.41
PHKG2 P15735 1/20 0.41
CDK2 P24941 1/20 0.41
AXL P30530 1/20 0.41
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
PRKCI P41743 1/20 0.41
SYK P43405 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
SCHEMBL28875440 0.89 KCNN4 (0.72) KCNN4KCNE1KCNQ1KIF11MAPT
SCHEMBL6688626 0.89 MAPT (0.52) KCNN4KCNE1KCNQ1MAPTKMT2A
SCHEMBL16892955 0.81 KCNN4 (0.68) KCNN4KCNE1KCNQ1MAPTKMT2A
Senicapoc SCHEMBL1443805 0.78 KCNN4 (1.00) KCNN4KCNE1KCNQ1KIF11MAPT
SCHEMBL2337394 0.78 KCNN4 (1.00) KCNN4KCNE1KCNQ1KIF11MAPT
SCHEMBL830791 0.77 MAPT (0.60) KCNN4KCNE1KCNQ1MAPTKMT2A
SCHEMBL6832584 0.77 KCNN4 (0.43) KCNN4MAPTKMT2A
SCHEMBL28151671 0.75 KCNN4 (0.68) KCNN4KCNE1KCNQ1KIF11MAPT
SCHEMBL5056595 0.75 KCNN4 (0.68) KCNN4KCNE1KCNQ1KIF11MAPT
SCHEMBL12811863 0.72 KCNN4 (0.86) KCNN4KCNE1KCNQ1KIF11

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
CN-102947315-A Inhibitors of protein tyrosine kinase activity METHYLGENE INC 2013-02-27 CN disclosed
CN-101932586-A Inhibition of protein tyrosine kinase activity METHYLGENE INC 2010-12-29 CN disclosed