SCHEMBL8074868

SCHEMBL8074868

CCOC(=O)C(O)(CO)CCCCCCOCc1ccc(OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 8/20 0.47
L3MBTL1 Q9Y468 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALDH1A1 P00352 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GBA1 P04062 1/20 0.40
UGCG Q16739 1/20 0.40
GBA2 Q9HCG7 1/20 0.40
GLA P06280 1/20 0.39
KMT2A Q03164 1/20 0.39
CACNA1G O43497 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM3 P20309 1/20 0.38

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
SCHEMBL8070650 0.87 L3MBTL1 (0.45) L3MBTL1TDP1ALDH1A1KMT2A
SCHEMBL8068601 0.81 CYP1A2 (0.40) TBXAS1L3MBTL1KMT2A
SCHEMBL8059314 0.80 CYP4F2 (0.33) TBXAS1L3MBTL1ALDH1A1HPGD
SCHEMBL5031752 0.79 ALDH1A1 (0.48) L3MBTL1TDP1ALDH1A1KDM4EGLA
SCHEMBL8073700 0.76 ALDH1A1 (0.39) L3MBTL1ALDH1A1KDM4EKMT2AHPGD
SCHEMBL8070393 0.76 ABCB11 (0.51)
SCHEMBL8070653 0.75 TDP1 (0.51) TDP1SMN1; SMN2
SCHEMBL16614410 0.74 L3MBTL1 (0.65) L3MBTL1TDP1GBA1UGCGGBA2
SCHEMBL6551488 0.74 L3MBTL1 (0.65) L3MBTL1TDP1GBA1UGCGGBA2
SCHEMBL27089915 0.74 L3MBTL1 (0.65) L3MBTL1TDP1GBA1UGCGGBA2

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
US-6030993-A INHIBITORS OF CARNITINE PALMITOYL TRANSFERASE; ANTIDIABETIC,-LIPEMIC AND HYPOGLYCEMIC AGENTS; SIDE EFFECT REDUCTION SANG SUP JEW (KR) 2000-02-29 US disclosed
WO-1998000389-A1 2-HYDROXYPROPIONIC ACID DERIVATIVE AND ITS MANUFACTURING METHOD JEW SANG SUP (KR) 1998-01-08 WO disclosed