SCHEMBL20056753

SCHEMBL20056753

CC(C)(C)OC(=O)N1CCCC1CN=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ PDE8B O95263 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ ATM Q13315 2/20 0.41
▸ OPRD1 P41143 1/20 0.41
▸ FPR3 P25089 1/20 0.40
▸ FPR2 P25090 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL20805862 0.86 HSD17B10 (0.48) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL12997526 0.86 HSD17B10 (0.48) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL16978942 0.86 HSD17B10 (0.48) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL135177 0.84 L3MBTL1 (0.58) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL133363 0.84 L3MBTL1 (0.58) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL47049 0.84 L3MBTL1 (0.58) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL1467517 0.84 HSD17B10 (0.49) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL3576321 0.84 HSD17B10 (0.49) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL6899788 0.84 HSD17B10 (0.49) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1
SCHEMBL3141725 0.84 HSD17B10 (0.49) HSD17B10ALDH1A1SMN1; SMN2TSHRMEN1

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
EP-1883627-B1 BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC (CA) 2018-04-18 — — EP disclosed
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