SCHEMBL8405103

SCHEMBL8405103

COC(=O)Cc1ccc(OC[C@H](C)N)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
LMNA P02545 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ADRB2 P07550 2/20 0.50
ADRB1 P08588 2/20 0.50
CNR1 P21554 1/20 0.50
ADRA1D P25100 1/20 0.50
ADRA1A P35348 1/20 0.50
ADRA1B P35368 1/20 0.50
CYP4F2 P78329 1/20 0.50
CYP4A11 Q02928 1/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
GLA P06280 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
THPO P40225 1/20 0.50

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
SCHEMBL8402101 1.00 ALDH1A1 (0.51) ALDH1A1NPC1RAB9ALMNATDP1
SCHEMBL4751700 0.87 ALDH1A1 (0.54) ALDH1A1NPC1RAB9ALMNATDP1
SCHEMBL11552159 0.84 LMNA (0.48) ALDH1A1NPC1RAB9ALMNATDP1
SCHEMBL27887827 0.83 FFAR1 (0.51) ALDH1A1NPC1RAB9ALMNATDP1
SCHEMBL25377756 0.81 GPR88 (0.51) ALDH1A1NPC1RAB9A
SCHEMBL8735791 0.80 CYP4F2 (0.56) ALDH1A1CYP4F2CYP4A11GAAGFER
SCHEMBL13754673 0.80 CYP4F2 (0.56) ALDH1A1CYP4F2CYP4A11GAAGFER
SCHEMBL6016784 0.79 ADRB2 (0.77) LMNATDP1ADRB2ADRB1CNR1
SCHEMBL9630745 0.79 ADRB2 (0.77) LMNATDP1ADRB2ADRB1CNR1
SCHEMBL4275929 0.78 SMN1; SMN2 (0.58) ALDH1A1NPC1RAB9ALMNATDP1

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
US-5977374-A 5-(4-hydroxy-OR 4-acetoxy-benzyl)-3- triphenylmethylthiazolidine-2,4-dione and method for producing same SANKYO COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5635534-A 1-PHENYL-2-(2-PHENYLOXY OR THIO)-1-METHYLETHYL)AMINOETHANOL DERIVATIVES; ALDOSE REDUCTASE INHIBITORS; NONTOXIC; ANTIDIABETIC,-OBESITY,-LIPEMIC AND HYPOGLYCEMIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-06-03 US disclosed
US-5576340-A Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 1996-11-19 US disclosed
EP-0543662-B1 Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses SANKYO CO (JP) 1996-09-18 EP disclosed
EP-0543662-A2 Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses Sankyo Company Limited (JP) 1993-05-26 EP disclosed