SCHEMBL9812059

SCHEMBL9812059

CC(N)Cc1ccc(OCC(N)=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.56
ADRB2 P07550 1/20 0.52
ADRB1 P08588 1/20 0.52
ADRB3 P13945 1/20 0.52
TAAR1 Q96RJ0 3/20 0.50
SLC6A2 P23975 1/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL9812052 1.00 SLC6A4 (0.56) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL9651945 0.87 SLC6A4 (0.56) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL14944934 0.87 SLC6A4 (0.56) SLC6A4ADRB2ADRB1ADRB3TAAR1
Hydrochloric Acid SCHEMBL9765308 0.85 SLC6A4 (0.54) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL8734031 0.84 SLC6A4 (0.57) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL8734027 0.84 SLC6A4 (0.57) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL11253726 0.84 SLC6A4 (0.57) SLC6A4ADRB2ADRB1ADRB3TAAR1
SCHEMBL10529495 0.83 TDP1 (0.49) ADRB2ADRB1MEN1KMT2A
SCHEMBL10529506 0.83 TDP1 (0.49) ADRB2ADRB1MEN1KMT2A
Hydrochloric Acid SCHEMBL9264979 0.83 SLC6A4 (0.56) SLC6A4ADRB2ADRB1ADRB3TAAR1

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
EP-0170121-B1 2-HYDROXY-3-ARYLOXYPROPYL OR 2-HYDROXY-2-BENZOFURANYL ETHYL TERTIARY AMINE HAVING AN ANTI-HYPERGLYCAEMIC AND/OR ANTI-OBESITY ACTIVITY BEECHAM GROUP PLC (GB) 1991-06-19 EP disclosed
EP-0170121-A1 2-Hydroxy-3-aryloxypropyl or 2-hydroxy-2-benzofuranyl ethyl tertiary amine having an anti-hyperglycaemic and/or anti-obesity activity BEECHAM GROUP PLC (GB) 1986-02-05 EP disclosed