SCHEMBL8155272

SCHEMBL8155272

Cn1nc(Cl)n(-c2ccccc2CCl)c1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MGLL Q99685 1/20 0.34
MAPK14 Q16539 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
BRD9 Q9H8M2 3/20 0.33
LMNA P02545 1/20 0.33
SETDB1 Q15047 2/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BRD7 Q9NPI1 1/20 0.33
KAT2B Q92831 2/20 0.32
BRD4 O60885 1/20 0.32
BPTF Q12830 1/20 0.32

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
SCHEMBL6600347 0.86 MALT1 (0.35) NPC1RAB9AMGLLMAPK14MEN1
SCHEMBL8660658 0.82 SETDB1 (0.39) BRD9LMNASETDB1SMN1; SMN2
SCHEMBL8664609 0.81 SETDB1 (0.37) MEN1KMT2ABRD9LMNASETDB1
SCHEMBL8675983 0.80 SETDB1 (0.38) ALDH1A1BRD9LMNASETDB1PKM
SCHEMBL8666669 0.79 SETDB1 (0.36) NPC1RAB9AMAPK14SETDB1PKM
SCHEMBL8667576 0.79 ALDH1A1 (0.39) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL6603431 0.79 HCAR1 (0.48) MGLLMEN1ALDH1A1KMT2ALMNA
SCHEMBL8499784 0.78 ALDH1A1 (0.36) MAPK14MEN1ALDH1A1KMT2ABRD9
SCHEMBL8590523 0.78 KDM4E (0.47) MEN1ALDH1A1KMT2ALMNAL3MBTL1
SCHEMBL8593864 0.75 SMN1; SMN2 (0.47) NPC1MGLLMAPK14ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874831-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-11-04 EP claimed
WO-1997019935-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-06-05 WO claimed
US-6057352-A CONTROLLING PLANT DISEASES CAUSED BY FUNGAL PLANT PATHOGENS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-02 US disclosed
US-5962436-A AGRICULTURE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-10-05 US disclosed
US-H1809-H Process for making oximes and use thereof to prepare cyclic urea fungicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-10-05 US disclosed
EP-0874831-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-11-04 EP disclosed
WO-1997019935-A1 PROCESSES AND COMPOUNDS FOR PREPARING CYCLIC UREA FUNGICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-06-05 WO disclosed
WO-1996026191-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-08-29 WO disclosed