SCHEMBL6548686

SCHEMBL6548686

ON=Cc1ccc(COc2c(Cl)cc(OCC=C(Cl)Cl)cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.47
NPC1 O15118 7/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
NFKB1 P19838 2/20 0.46
NFKB2 Q00653 2/20 0.46
RELA Q04206 2/20 0.46
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 5/20 0.43
MAPT P10636 5/20 0.43
CYP1A2 P05177 4/20 0.43
CYP3A4 P08684 4/20 0.43
CYP2C19 P33261 4/20 0.43
CYP2D6 P10635 2/20 0.43
NPSR1 Q6W5P4 3/20 0.42

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
SCHEMBL6548683 1.00 RAB9A (0.47) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6548054 0.88 KMT2A (0.40) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6548011 0.88 ALDH1A1 (0.39) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6548050 0.88 KMT2A (0.40) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6550165 0.88 ALDH1A1 (0.39) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6549969 0.87 KMT2A (0.37) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6549966 0.87 KMT2A (0.37) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6549505 0.85 KMT2A (0.38) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6549508 0.85 KMT2A (0.38) RAB9ANPC1SMN1; SMN2CASP3SENP8
SCHEMBL6548563 0.85 CYP1A2 (0.41) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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
EP-0975586-B1 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2004-12-01 EP claimed
EP-0975586-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION Sumitomo Chemical Company, Limited (JP) 2000-02-02 EP claimed
WO-1998045254-A2 OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-15 WO claimed