SCHEMBL5264465

SCHEMBL5264465

CC(C)c1ccc(CCNc2ncnc3scc(Cl)c23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 5/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ AURKB Q96GD4 5/20 0.48
▸ DYRK3 O43781 3/20 0.48
▸ MAP4K4 O95819 3/20 0.48
▸ EGFR P00533 3/20 0.48
▸ PIM1 P11309 3/20 0.48
▸ CLK2 P49760 3/20 0.48
▸ IRAK1 P51617 3/20 0.48
▸ CSNK2A1 P68400 3/20 0.48
▸ MAP4K2 Q12851 3/20 0.48
▸ DYRK1A Q13627 3/20 0.48
▸ CLK4 Q9HAZ1 3/20 0.48
▸ PIM3 Q86V86 2/20 0.48
▸ MKNK2 Q9HBH9 2/20 0.48
▸ HIPK4 Q8NE63 2/20 0.48
▸ SRPK1 Q96SB4 1/20 0.48
▸ CSNK1G1 Q9HCP0 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.45

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
SCHEMBL2186218 0.85 DYRK3 (0.63) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL12392647 0.82 DYRK3 (0.50) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL12392593 0.82 DYRK3 (0.49) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL13841685 0.81 DYRK3 (0.45) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL3868621 0.81 DYRK3 (0.45) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL13841735 0.80 PIP4K2C (0.38) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL1160807 0.80 DYRK3 (0.44) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL12392367 0.80 EGFR (0.50) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL12392659 0.79 HTT (0.46) HTTSMN1; SMN2RAB9AAURKBDYRK3
SCHEMBL13841601 0.79 SMN1; SMN2 (0.49) HTTSMN1; SMN2RAB9AAURKBDYRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8008487-B2 Substituted thieno[2,3-D]pyrimidines as fungicides DOW AGROSCIENCES LLC (US) 2011-08-30 — — US disclosed
US-8008487-B2 Substituted thieno[2,3-D]pyrimidines as fungicides DOW AGROSCIENCES LLC (US) 2011-08-30 — — US disclosed
EP-1802632-A1 THIENO-PYRIMIDINE COMPOUNDS HAVING FUNGICIDAL ACTIVITY Dow AgroSciences LLC (US) 2007-07-04 — — EP disclosed
WO-2006047397-A1 THIENO-PYRIMIDINE COMPOUNDS HAVING FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2006-05-04 — — WO disclosed
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