SCHEMBL4792009

SCHEMBL4792009

COc1ccc2cc(C=C3N=C(Nc4ccc(Cc5nnn[nH]5)cc4)NC3=O)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK2 Q92630 17/20 0.53
DYRK1A Q13627 15/20 0.53
DYRK1B Q9Y463 15/20 0.53
DYRK3 O43781 14/20 0.53
CSNK2A2 P19784 5/20 0.53
CSNK2B P67870 5/20 0.53
CSNK2A1 P68400 5/20 0.53
CSNK2A3 Q8NEV1 5/20 0.53
PIM1 P11309 8/20 0.53
CNR1 P21554 3/20 0.48
CLK1 P49759 2/20 0.44
CLK2 P49760 2/20 0.44
CLK4 Q9HAZ1 2/20 0.44
CLK3 P49761 1/20 0.44
GSK3B P49841 1/20 0.44
CCNT1 O60563 2/20 0.41
CDK9 P50750 2/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 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
SCHEMBL4127969 0.81 ALOX5 (0.46)
SCHEMBL4127964 0.81 ALOX5 (0.46)
SCHEMBL4792013 0.75 HDAC4 (0.34)
SCHEMBL4120717 0.70 ALOX5 (0.41) PIM1GSK3B
SCHEMBL4120713 0.70 ALOX5 (0.41) PIM1GSK3B
SCHEMBL6150323 0.68 LTA4H (0.47)
SCHEMBL23510744 0.68 DYRK1A (0.77) DYRK2DYRK1ADYRK1BDYRK3CSNK2A2
SCHEMBL29899849 0.68 DYRK1A (0.77) DYRK2DYRK1ADYRK1BDYRK3CSNK2A2
SCHEMBL28842954 0.68 DYRK1A (0.77) DYRK2DYRK1ADYRK1BDYRK3CSNK2A2
SCHEMBL29310479 0.66 ALOX5 (0.80) DYRK2DYRK1ADYRK1BDYRK3CSNK2A2

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
EP-1934192-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS Torrent Pharmaceuticals Ltd (IN) 2008-06-25 EP disclosed
WO-2007032028-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS TORRENT PHARMACEUTICALS LTD. (IN) 2007-03-22 WO disclosed