SCHEMBL8406998

SCHEMBL8406998

CC(COc1ccc(CCO)cc1)NC[C@@H](O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ ADRB3 P13945 11/20 0.52
▸ ADRB2 P07550 6/20 0.52
▸ ADRB1 P08588 6/20 0.52
▸ ADRA1D P25100 1/20 0.49
▸ ADRA1A P35348 1/20 0.49
▸ ADRA1B P35368 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ SLC2A1 P11166 4/20 0.48
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL8406994 1.00 MEN1 (0.52) MEN1ALDH1A1KMT2AADRB3ADRB2
SCHEMBL8402065 0.87 ADRB3 (0.70) ADRB3ADRB2ADRB1ADRA1DADRA1A
SCHEMBL8402453 0.85 ADRB1 (0.61) MEN1ALDH1A1KMT2AADRB3ADRB2
SCHEMBL10890749 0.84 KMT2A (0.49) MEN1ALDH1A1KMT2AADRB3ADRB2
SCHEMBL8405956 0.82 ADRB1 (0.53) KMT2AADRB3ADRB2ADRB1ADRA1D
SCHEMBL8406923 0.82 ADRB1 (0.53) KMT2AADRB3ADRB2ADRB1ADRA1D
SCHEMBL8406383 0.82 ADRB1 (0.53) KMT2AADRB3ADRB2ADRB1ADRA1D
SCHEMBL8402469 0.82 ADRB1 (0.53) KMT2AADRB3ADRB2ADRB1ADRA1D
SCHEMBL8406379 0.82 ADRB1 (0.53) KMT2AADRB3ADRB2ADRB1ADRA1D
SCHEMBL8402465 0.82 ADRB3 (0.69) ADRB3ADRB2ADRB1ADRA1DADRA1A

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
Send feedback