SCHEMBL14101263

SCHEMBL14101263

CN(Cc1cnc(Cl)s1)C1=CC(=O)SC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 5/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
BMP1 P13497 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL12949772 0.78 LMNA (0.34) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL12863913 0.72 ALDH1A1 (0.34) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL13223227 0.69 KMT2A (0.44) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL229674 0.69 LMNA (0.34) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL19672954 0.67 KMT2A (0.42) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL15296287 0.63 KMT2A (0.39) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL15296925 0.61 L3MBTL1 (0.43) LMNAALDH1A1GAAKMT2AMEN1
SCHEMBL16470410 0.61 MAPT (0.44) LMNAGAAKMT2AMEN1MAPT
SCHEMBL123610 0.61 KDM4E (0.31) KDM4E
SCHEMBL10028749 0.60 KMT2A (0.36) LMNAALDH1A1GAAKMT2AMEN1

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-7417150-B2 Azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2008-08-26 US disclosed
US-7417150-B2 Azoles having an insecticidal action BAYER CROPSCIENCE AG (DE) 2008-08-26 US disclosed
EP-1383751-B1 NOVEL AZOLES HAVING AN INSECTICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2007-01-17 EP disclosed