SCHEMBL4772766

SCHEMBL4772766

O=C1NC(=Nc2ccccc2Cl)SC1=Cc1cccc2cccnc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 4/20 0.69
GSK3B P49841 3/20 0.58
MEN1 O00255 4/20 0.58
POLB P06746 4/20 0.58
KMT2A Q03164 4/20 0.58
NSD2 O96028 1/20 0.58
CASP6 P55212 1/20 0.58
PTPN11 Q06124 1/20 0.57
GALR3 O60755 1/20 0.55
USP2 O75604 1/20 0.55
TUBB4A P04350 1/20 0.53
TUBB P07437 1/20 0.53
TUBA3C P0DPH7 1/20 0.53
TUBA1B P68363 1/20 0.53
TUBA4A P68366 1/20 0.53
TUBB4B P68371 1/20 0.53
TUBB3 Q13509 1/20 0.53
TUBB2A Q13885 1/20 0.53
TUBB8 Q3ZCM7 1/20 0.53
TUBA3E Q6PEY2 1/20 0.53

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
SCHEMBL4772304 0.88 DYRK3 (0.68) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4765545 0.87 DYRK3 (0.57) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4770970 0.85 DYRK3 (0.52) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4771030 0.85 DYRK3 (0.53) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4770141 0.85 MEN1 (0.56) DYRK3MEN1POLBKMT2APTPN11
SCHEMBL4772146 0.85 DYRK3 (0.54) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4775509 0.85 DYRK3 (0.55) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL4774341 0.84 MAPT (0.64) DYRK3MEN1POLBKMT2ANSD2
SCHEMBL4770725 0.83 DYRK3 (0.51) DYRK3GSK3BMEN1POLBKMT2A
SCHEMBL2786117 0.82 DYRK3 (1.00) DYRK3GSK3BMEN1POLBKMT2A

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
EP-1567112-B1 THIAZOLIDIN-4-ONES FOR INHIBITING hYAK3 PROTEINS SMITHKLINE BEECHAM CORP (US) 2008-10-15 EP claimed