SCHEMBL9835627

SCHEMBL9835627

C=C(C)C(OC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.52
MAPT P10636 6/20 0.50
LMNA P02545 5/20 0.50
GAA P10253 2/20 0.50
ALDH1A1 P00352 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TP53 P04637 1/20 0.49
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
NPSR1 Q6W5P4 2/20 0.48
XBP1 P17861 1/20 0.48
HTT P42858 3/20 0.48
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.46
NPC1 O15118 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL9837072 0.88 MAPT (0.46) MAPTLMNAALDH1A1
SCHEMBL9834886 0.85 EPHX2 (0.46) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL9837242 0.84 KDM4E (0.48) SMN1; SMN2MAPTGAATP53MEN1
SCHEMBL9835063 0.82 TMPRSS4 (0.46) SMN1; SMN2MAPTKMT2ARAB9AKDM4E
SCHEMBL9833996 0.81 SMN1; SMN2 (0.45) SMN1; SMN2MAPTLMNAGAAALDH1A1
SCHEMBL9837187 0.80 AR (0.46)
SCHEMBL9335041 0.79 HPGD (0.62) SMN1; SMN2MAPTLMNAGAAALDH1A1
SCHEMBL9837102 0.79 KMT2A (0.49) SMN1; SMN2MAPTLMNAGAAALDH1A1
SCHEMBL515008 0.79 SMN1; SMN2 (0.68) SMN1; SMN2MAPTLMNAGAAALDH1A1
SCHEMBL9833790 0.78 SMN1; SMN2 (0.56) SMN1; SMN2MAPTLMNAALDH1A1MEN1

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