SCHEMBL7929872

SCHEMBL7929872

O=C(O)c1cc2c(-c3ccc(Cl)c(Cl)c3)cncc2s1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 11/20 0.69
GSK3B P49841 10/20 0.69
PIM1 P11309 10/20 0.69
DYRK1A Q13627 10/20 0.69
CSNK1D P48730 9/20 0.69
CDK2 P24941 9/20 0.69
AURKB Q96GD4 8/20 0.69
CHEK2 O96017 8/20 0.69
MAPK9 P45984 8/20 0.69
CDK1 P06493 8/20 0.69
CSNK2A1 P68400 7/20 0.69
DAPK3 O43293 7/20 0.69
PLK4 O00444 7/20 0.69
AURKA O14965 7/20 0.69
PLK3 Q9H4B4 6/20 0.69
RPS6KA3 P51812 6/20 0.69
PRKACA P17612 6/20 0.69
SGK2 Q9HBY8 6/20 0.69
PIM2 Q9P1W9 4/20 0.69
MAP3K8 P41279 5/20 0.67

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
SCHEMBL7053722 0.88 PIM1 (0.69) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7797363 0.86 GSK3A (0.77) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7619323 0.82 GSK3A (1.00) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7934399 0.81 GSK3A (0.78) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL5555935 0.80 MAP3K8 (1.00) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL658705 0.78 ICAM1 (0.73) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7111799 0.78 GSK3A (0.64) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7250463 0.78 MAP3K8 (0.77) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL7055360 0.75 PIM1 (0.76) GSK3AGSK3BPIM1DYRK1ACSNK1D
SCHEMBL5550778 0.74 PIM1 (0.78) GSK3AGSK3BPIM1DYRK1ACSNK1D

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
US-6232320-B1 THIENO(2,3-C)PYRIDINE AND 5H-THIENO(2,3-C)PYRAN DERIATIVES ABBOTT LABORATORIES 2001-05-15 US disclosed