SCHEMBL13499582

SCHEMBL13499582

COc1cc(F)c(/C=C2\SC(=S)NC2=O)cc1O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 3/20 0.76
▸ MAOB P27338 2/20 0.76
▸ DYRK1A Q13627 3/20 0.63
▸ PIM1 P11309 2/20 0.63
▸ PIM3 Q86V86 2/20 0.63
▸ PIM2 Q9P1W9 2/20 0.63
▸ MAOA P21397 1/20 0.63
▸ CDC7 O00311 1/20 0.63
▸ PLK4 O00444 1/20 0.63
▸ DAPK3 O43293 1/20 0.63
▸ DYRK3 O43781 1/20 0.63
▸ PRKD3 O94806 1/20 0.63
▸ MAP4K4 O95819 1/20 0.63
▸ PRKCG P05129 1/20 0.63
▸ CDK1 P06493 1/20 0.63
▸ RPS6KB1 P23443 1/20 0.63
▸ AKT1 P31749 1/20 0.63
▸ CSNK1A1 P48729 1/20 0.63
▸ CSNK1D P48730 1/20 0.63
▸ CLK2 P49760 1/20 0.63

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
SCHEMBL30841466 0.86 CISD1 (1.00) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL13499560 0.80 PTP4A3 (0.65) CISD1PIM1NAT1CA2PTP4A3
SCHEMBL8172590 0.78 CISD1 (0.80) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL8172592 0.78 CISD1 (0.80) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL1641525 0.78 DYRK1A (0.81) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL2199251 0.78 DYRK1A (1.00) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL18102869 0.78 CISD1 (0.71) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL4806036 0.78 CA2 (0.71) CISD1MAOBDYRK1AGSK3BNAT1
SCHEMBL2199252 0.78 DYRK1A (1.00) CISD1MAOBDYRK1APIM1PIM3
SCHEMBL4801244 0.78 CA2 (0.71) CISD1MAOBDYRK1AGSK3BNAT1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431376-B2 Bacterial replication systems and methods THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2013-04-30 — — US disclosed
US-20100028862-A1 BACTERIAL REPLICATION SYSTEMS AND METHODS Replidyne,Inc. (US) 2010-02-04 — — US disclosed
WO-2006071255-A9 BACTERIAL REPLICATION SYSTEMS AND METHODS REPLIDYNE INC (US) 2007-02-15 — — WO disclosed
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