SCHEMBL9836702

SCHEMBL9836702

CC=C(C)C(O)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.36
CA14 Q9ULX7 2/20 0.33
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
KMT2A Q03164 2/20 0.31
CA12 O43570 1/20 0.31
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL9836699 1.00 SMN1; SMN2 (0.39) SMN1; SMN2ALDH1A1CA14KEAP1NFE2L2
SCHEMBL5411165 0.78 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1CA14KEAP1NFE2L2
SCHEMBL23255849 0.77 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1CA14KEAP1NFE2L2
SCHEMBL4011535 0.76
SCHEMBL7618452 0.75 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CA14KEAP1NFE2L2
SCHEMBL9835712 0.74 CA1 (0.36) SMN1; SMN2ALDH1A1LMNAHSD17B10CA1
SCHEMBL9835716 0.74 CA1 (0.36) SMN1; SMN2ALDH1A1LMNAHSD17B10CA1
SCHEMBL7928848 0.72
SCHEMBL13219421 0.70
SCHEMBL6671784 0.70

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