SCHEMBL7519381

SCHEMBL7519381

C=CCOc1ccccc1OC[C@@H]1CO1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
GLA P06280 1/20 0.60
TDP1 Q9NUW8 1/20 0.51
TSHR P16473 3/20 0.46
CYP3A4 P08684 2/20 0.46
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
LIG1 P18858 1/20 0.45
HPGD P15428 2/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ADRB2 P07550 2/20 0.41
HTR1A P08908 2/20 0.41
HTR2A P28223 2/20 0.41
SLC6A4 P31645 2/20 0.41
ADRA1A P35348 2/20 0.41
ADRA2C P18825 2/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2B P41595 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
SCHEMBL7460830 1.00 ALDH1A1 (0.60) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL7054912 1.00 ALDH1A1 (0.60) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL31384189 1.00 ALDH1A1 (0.60) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL22357196 0.86 ALDH1A1 (0.78) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL679937 0.86 ALDH1A1 (0.78) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL9630670 0.84 ALDH1A1 (0.57) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL7315191 0.82 ALDH1A1 (0.51) ALDH1A1GLATDP1TSHRCYP3A4
SCHEMBL5957095 0.82 TSHR (0.48) ALDH1A1GLATSHRCYP3A4TP53
SCHEMBL5957092 0.82 TSHR (0.48) ALDH1A1GLATSHRCYP3A4TP53
SCHEMBL6632887 0.81 TDP1 (0.43) ALDH1A1GLATDP1TSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930291-B1 PROCESS FOR THE PREPARATION OF 3-AMINO-2-HYDROXY-1-PROPYL ETHERS DAISO CO LTD (JP) 2002-08-14 EP disclosed
US-6057476-A Process for the preparation of 3-amino-2-hydroxy-1-propyl ethers DAISO CO., LTD. (JP) 2000-05-02 US disclosed
EP-0930291-A1 PROCESS FOR THE PREPARATION OF 3-AMINO-2-HYDROXY-1-PROPYL ETHERS DAISO CO., LTD. (JP) 1999-07-21 EP disclosed
US-5380654-A Process for the preparation of epoxides of means of microorganisms JAPAN ENERGY CORPORATION (JP) 1995-01-10 US disclosed
US-5376539-A Aerobic incubation of allyl phenyl ether with arthrobacter, brevibacterium, corynebacterium, pseudomonas or rhodococcus yields glycidyl phenyl ether NIPPON MINING CO., LTD. (JP) 1994-12-27 US disclosed