SCHEMBL9833989

SCHEMBL9833989

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

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 3/20 0.38
SMN1; SMN2 Q16637 4/20 0.35
MAPT P10636 3/20 0.35
PKM P14618 1/20 0.35
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
GAA P10253 2/20 0.34
CHRM3 P20309 3/20 0.33
HPGD P15428 1/20 0.33
CA12 O43570 1/20 0.33

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
SCHEMBL9836230 0.88 SMN1; SMN2 (0.46) ALDH1A1NPSR1NPC1RAB9APOLB
SCHEMBL9835199 0.88 NPC1 (0.39) ALDH1A1NPSR1NPC1RAB9AMEN1
SCHEMBL9867843 0.85 MEN1 (0.41) ALDH1A1KDM4ENPSR1RAB9AMEN1
SCHEMBL9835593 0.85 NPSR1 (0.47) ALDH1A1NPSR1MEN1KMT2A
SCHEMBL27522368 0.85 MAPT (0.46) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL9835088 0.82 HTT (0.40) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL9835566 0.79 ALDH1A1 (0.44) ALDH1A1NPC1RAB9AMEN1KMT2A
SCHEMBL23997341 0.78 HPGD (0.51) RXFP1ALDH1A1KDM4ENPSR1NPC1
SCHEMBL30336857 0.78 HPGD (0.51) RXFP1ALDH1A1KDM4ENPSR1NPC1
SCHEMBL9835147 0.78 EGFR (0.37) ALDH1A1NPSR1NPC1RAB9ASMN1; SMN2

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