SCHEMBL4189640

SCHEMBL4189640

O=C1NC(=O)/C(=C\c2ccc3ncnc(-c4ccsc4)c3c2)S1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.56
PIK3CD O00329 2/20 0.56
CSNK2A2 P19784 2/20 0.56
PIK3CA P42336 2/20 0.56
PIK3CB P42338 2/20 0.56
MTOR P42345 2/20 0.56
PIK3CG P48736 2/20 0.56
CLK1 P49759 2/20 0.56
DYRK1A Q13627 2/20 0.56
GAK O14976 1/20 0.56
RPS6KA4 O75676 1/20 0.56
STK10 O94804 1/20 0.56
MAP2K2 P36507 1/20 0.56
CSNK1D P48730 1/20 0.56
CLK2 P49760 1/20 0.56
CSNK1G2 P78368 1/20 0.56
MAP2K1 Q02750 1/20 0.56
AAK1 Q2M2I8 1/20 0.56
Q6ZSR9 Q6ZSR9 1/20 0.56
TAOK1 Q7L7X3 1/20 0.56

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
SCHEMBL4189638 1.00 PIM1 (0.56) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL4189642 1.00 PIM1 (0.56) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL2884674 0.85 PIM1 (0.56) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL2884671 0.85 PIM1 (0.56) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL12975452 0.85 PIM1 (0.56) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL4201157 0.81 PIM1 (0.54) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL13951164 0.81 PIM1 (0.54) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL4201155 0.81 PIM1 (0.54) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL4194056 0.80 PIM1 (0.53) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB
SCHEMBL4347432 0.80 PIM1 (0.53) PIM1PIK3CDCSNK2A2PIK3CAPIK3CB

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
WO-2009026346-A1 THIAZOLIDINE COMPOUNDS, AND METHODS OF MAKING AND USING SAME TARGEGEN INC. (US) 2009-02-26 WO claimed
WO-2009026346-A1 THIAZOLIDINE COMPOUNDS, AND METHODS OF MAKING AND USING SAME TARGEGEN INC. (US) 2009-02-26 WO disclosed