SCHEMBL8105528

SCHEMBL8105528

O=Cc1ccc(OC[C@@H]2CO2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.60
LMNA P02545 3/20 0.60
PKM P14618 2/20 0.60
GAA P10253 1/20 0.60
TDP1 Q9NUW8 1/20 0.59
HPGD P15428 4/20 0.56
MAPT P10636 4/20 0.56
TP53 P04637 3/20 0.56
TSHR P16473 3/20 0.56
HIF1A Q16665 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
CYP1A2 P05177 1/20 0.56
PPARG P37231 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
CYP3A4 P08684 1/20 0.53
KDM4E B2RXH2 2/20 0.50
PARP1 P09874 1/20 0.44
MIF P14174 1/20 0.44
CYP2A6 P11509 1/20 0.42

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
SCHEMBL3466095 1.00 ALDH1A1 (0.60) ALDH1A1LMNAPKMGAATDP1
SCHEMBL7694361 1.00 ALDH1A1 (0.60) ALDH1A1LMNAPKMGAATDP1
SCHEMBL1160623 0.95 ALDH1A1 (0.55) ALDH1A1LMNAPKMGAATDP1
SCHEMBL24390624 0.85 ALDH1A1 (0.54) ALDH1A1LMNAPKMGAATDP1
SCHEMBL6813905 0.85 TDP1 (0.63) ALDH1A1LMNAPKMGAATDP1
SCHEMBL6813909 0.85 TDP1 (0.63) ALDH1A1LMNAPKMGAATDP1
SCHEMBL14063109 0.85 TDP1 (0.63) ALDH1A1LMNAPKMGAATDP1
SCHEMBL24390598 0.85 ALDH1A1 (0.46) ALDH1A1LMNAPKMGAATDP1
SCHEMBL21094081 0.84 TDP1 (0.79) ALDH1A1LMNAPKMGAATDP1
SCHEMBL20677146 0.84 TDP1 (0.79) ALDH1A1LMNAPKMGAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0605729-B1 OXAZOLIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2000-07-26 EP disclosed
US-5480899-A ANTILIPEMIC AGENTS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1996-01-02 US disclosed
EP-0605729-A1 OXAZOLIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 1994-07-13 EP disclosed