SCHEMBL9835199

SCHEMBL9835199

C=C(C)C(OC(=O)Nc1ccc(Br)cc1Br)C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.39
HPGD P15428 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 3/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
L3MBTL1 Q9Y468 4/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 3/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPK1 P28482 1/20 0.34
GAA P10253 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
SCHEMBL9867843 0.88 MEN1 (0.41) HPGDSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL9833989 0.88 RXFP1 (0.41) NPC1HPGDSMN1; SMN2RAB9AMEN1
SCHEMBL9835147 0.84 EGFR (0.37) NPC1SMN1; SMN2RAB9AL3MBTL1ALDH1A1
SCHEMBL9835088 0.84 HTT (0.40) NPC1SMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL9835722 0.83 SMN1; SMN2 (0.32) SMN1; SMN2ALDH1A1
SCHEMBL9836146 0.81 GAA (0.44) NPC1HPGDSMN1; SMN2RAB9ANFKB1
SCHEMBL9836230 0.77 SMN1; SMN2 (0.46) NPC1SMN1; SMN2RAB9APOLBALDH1A1
SCHEMBL9866362 0.77 NPC1 (0.39) NPC1HPGDSMN1; SMN2RAB9ANFKB1
SCHEMBL9834529 0.77 USP2 (0.50) NPC1HPGDSMN1; SMN2RAB9AMEN1
SCHEMBL9835414 0.76 MAPT (0.42) NPC1HPGDSMN1; SMN2RAB9AMEN1

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
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed