SCHEMBL23378337

SCHEMBL23378337

Cc1nc(Cl)c2sc3ncccc3c2n1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.69
CLK1 P49759 4/20 0.47
CDC7 O00311 1/20 0.47
DBF4 Q9UBU7 1/20 0.47
PIK3CA P42336 2/20 0.42
NPC1 O15118 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
PRKCI P41743 5/20 0.40
ALDH1A1 P00352 2/20 0.39
HSP90AA1 P07900 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
EGFR P00533 1/20 0.36
TLR5 O60602 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL1164810 0.84 LIMK1 (0.52) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL23378544 0.81 PIK3CA (0.59) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL23378415 0.81 LIMK1 (0.50) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL9042411 0.76 CLK1 (0.67) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL30093319 0.76 CLK1 (0.67) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL23378453 0.75 LIMK1 (0.44) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL23378174 0.74 LIMK1 (0.43) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL7991134 0.72 PIK3CA (0.45) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL25662796 0.72 LIMK1 (0.56) LIMK1CLK1CDC7DBF4PIK3CA
SCHEMBL16919875 0.71 CLK1 (0.55) LIMK1CLK1CDC7DBF4PIK3CA

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-2021095032-A1 GLUCOSE UPTAKE INHIBITORS AND USES THEREOF METABOMED LTD (IL) 2021-05-20 WO disclosed