SCHEMBL31336384

SCHEMBL31336384

CC(C)(C)OC(=O)N1CCCCCCC1C=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
EPHX1 P07099 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
PREP P48147 2/20 0.40
PDE8B O95263 1/20 0.39
NPC1 O15118 1/20 0.39
CTSK P43235 1/20 0.39

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
SCHEMBL25980668 1.00 HPGD (0.47) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL14398395 1.00 HPGD (0.47) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL1991177 0.98 HSD17B10 (0.45) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL2896341 0.98 HSD17B10 (0.45) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL1991179 0.98 HSD17B10 (0.45) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL40804 0.94 HSD17B10 (0.49) HPGDHSD17B10SMN1; SMN2ALDH1A1MEN1
SCHEMBL338312 0.94 HSD17B10 (0.49) HPGDHSD17B10SMN1; SMN2ALDH1A1MEN1
SCHEMBL190173 0.94 HSD17B10 (0.49) HPGDHSD17B10SMN1; SMN2ALDH1A1MEN1
SCHEMBL17980096 0.87 HSD17B10 (0.41) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL2030521 0.87 HSD17B10 (0.41) HPGDEPHX1HSD17B10SMN1; SMN2ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113302184-B 1,3, 4-Oxadiazolinone compounds and medicaments 日本新药株式会社 2024-11-22 CN disclosed