SCHEMBL22490151

SCHEMBL22490151

CCC(CC)C(=O)OCC1COC(=O)O1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 2/20 0.33
RECQL P46063 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FFAR1 O14842 2/20 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
SCHEMBL11957683 0.89 CA2 (0.45) L3MBTL1MAPK1
SCHEMBL16591121 0.86 LMNA (0.33) L3MBTL1MAPK1ALDH1A1RECQLSMN1; SMN2
SCHEMBL20691764 0.85 L3MBTL1 (0.35) L3MBTL1MAPK1ALDH1A1RECQL
SCHEMBL9415904 0.84 L3MBTL1 (0.35) L3MBTL1MAPK1ALDH1A1RECQL
SCHEMBL17717878 0.81 L3MBTL1 (0.34) L3MBTL1MAPK1ALDH1A1
SCHEMBL8157771 0.81 L3MBTL1 (0.35) L3MBTL1MAPK1ALDH1A1RECQLSMN1; SMN2
SCHEMBL29329710 0.81 SMN1; SMN2 (0.36) L3MBTL1MAPK1ALDH1A1RECQLSMN1; SMN2
SCHEMBL30114611 0.81 L3MBTL1 (0.35) L3MBTL1MAPK1ALDH1A1RECQLSMN1; SMN2
SCHEMBL1952351 0.81 SMN1; SMN2 (0.36) L3MBTL1MAPK1ALDH1A1RECQLSMN1; SMN2
SCHEMBL2497151 0.81 L3MBTL1 (0.38) L3MBTL1MAPK1ALDH1A1

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
WO-2020196845-A1 COATING COMPOSITION AND COATING FILM 大日精化工業株式会社 2020-10-01 WO disclosed