SCHEMBL28874216

SCHEMBL28874216

CC(=O)OCC(=O)N1CCOCC1.CCCNC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ POLB P06746 3/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ TSHR P16473 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ FKBP1A P62942 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ GLA P06280 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL14446152 0.85 L3MBTL1 (0.66) L3MBTL1POLBRAB9ATSHRLMNA
Propionamide SCHEMBL28303740 0.80 L3MBTL1 (0.54) L3MBTL1POLBRAB9ATSHRLMNA
SCHEMBL28874217 0.78 POLB (0.51) L3MBTL1POLBRAB9ATSHRLMNA
SCHEMBL13645749 0.76 GLA (0.54) L3MBTL1POLBRAB9ATSHRHTT
SCHEMBL28126115 0.72 L3MBTL1 (0.61) L3MBTL1POLBRAB9ATSHRLMNA
SCHEMBL13135936 0.72 HTT (0.52) L3MBTL1POLBRAB9ATSHRHTT
SCHEMBL2760109 0.72 HTT (0.77) TSHRHTTLMNAALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL23466967 0.71 L3MBTL1 (0.59) L3MBTL1POLBRAB9ATSHRLMNA
SCHEMBL18780592 0.69 RAB9A (0.53) RAB9AHTTALDH1A1SMN1; SMN2
SCHEMBL2025855 0.69 RAB9A (0.49) RAB9AHTTALDH1A1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459058-B Compound and composition as 7 agonist of TOLL- sample receptor 诺华股份有限公司 2019-07-05 — — CN disclosed
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