SCHEMBL7134405

SCHEMBL7134405

CNC(=S)C(C)Oc1ccc(Cl)nc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
CHRNA3 P32297 1/20 0.34

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
SCHEMBL6988139 0.82 LMNA (0.33) CHRNB2CHRNA4
SCHEMBL6985718 0.82 ALDH1A1 (0.35) ALDH1A1CHRNB2CHRNA4
SCHEMBL6988136 0.82 LMNA (0.33) CHRNB2CHRNA4
SCHEMBL6988636 0.81 DGAT1 (0.36) NPC1ALDH1A1RAB9ACHRNB2CHRNA4
SCHEMBL20045392 0.76 CYP1A2 (0.51) MEN1MAPTKMT2AL3MBTL1
SCHEMBL21276509 0.76 CYP1A2 (0.51) MEN1MAPTKMT2AL3MBTL1
SCHEMBL1547199 0.75 CHRNB2 (0.42) CHRNB2CHRNA4CHRNA3
SCHEMBL1747714 0.73 CYP3A4 (0.39) RAB9ACHRNB2CHRNA4
SCHEMBL7135737 0.73 POLB (0.48)
SCHEMBL7135739 0.73 POLB (0.48)

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-1313704-A2 COMPOUNDS USEFUL AS INSECTICIDES, COMPOUNDS USEFUL AS ACARICIDES, AND PROCESSES TO USE AND MAKE SAME Dow AgroSciences LLC (US) 2003-05-28 EP disclosed
WO-2002018339-A2 COMPOUNDS USEFUL AS INSECTICIDES, COMPOUNDS USEFUL AS ACARICIDES, AND PROCESSES TO USE AND MAKE SAME DOW AGROSCIENCES LLC (US) 2002-03-07 WO disclosed