SCHEMBL8945270

SCHEMBL8945270

CCOC(=O)C1(C)OC1c1cc(C)c(C)cc1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 3/20 0.32
HSD17B10 Q99714 3/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GLA P06280 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GAA P10253 2/20 0.31
MAPK1 P28482 2/20 0.31
ATM Q13315 1/20 0.31
CUL4A Q13619 1/20 0.31
CYP3A4 P08684 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL16110306 0.74 OPRM1 (0.40) ALDH1A1KDM4EMAPTSMN1; SMN2GAA
SCHEMBL57714 0.74 TSHR (0.49) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL16108680 0.71 ALDH1A1 (0.50) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL27579706 0.70 ABCC1 (0.38) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL7061157 0.69 ALDH1A1 (0.39) MEN1KMT2AALDH1A1KDM4EHSD17B10
SCHEMBL7175636 0.66 ALDH1A1 (0.36) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL13049436 0.65 IDO1 (0.41) L3MBTL1MEN1KMT2AALDH1A1KDM4E
SCHEMBL16109753 0.65 ALDH1A1 (0.35) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL1006687 0.65 MAPT (0.32) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL16110561 0.63 TSHR (0.38) L3MBTL1MEN1KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8053433-A None JP disclosed
JP-H0853433-A ALPHA-ALKYL-SUBSTITUTED-BETA-(3754/24)2,4,5-TRIMETHYLPHENYL)-GLYCIDIC ACID ESTER AND PERFUME COMPOSITION CONTAINING THE SAME COMPOUND TSUMURA & CO 1996-02-27 JP disclosed