SCHEMBL28520767

SCHEMBL28520767

O=C(CC(O)c1cccc(Cl)c1)NO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.50
ADRB1 P08588 1/20 0.50
ADRB3 P13945 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
SCHEMBL11537145 0.83 MEN1 (0.48)
SCHEMBL3188188 0.81 MEN1 (0.53) ADRB2ADRB1ADRB3
SCHEMBL3188356 0.81 MEN1 (0.53) ADRB2ADRB1ADRB3
SCHEMBL16788643 0.80 L3MBTL1 (0.49) ADRB2ADRB1ADRB3
SCHEMBL15590888 0.80 L3MBTL1 (0.49) ADRB2ADRB1ADRB3
SCHEMBL31399399 0.80 HDAC4 (0.52)
SCHEMBL13482971 0.79 ADRB3 (0.53) ADRB2ADRB1ADRB3
SCHEMBL8770895 0.79 ADRB3 (0.53) ADRB2ADRB1ADRB3
SCHEMBL30088535 0.79 ADRB3 (0.53) ADRB2ADRB1ADRB3
SCHEMBL11911572 0.77 NPC1 (0.50) ADRB2ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108863797-B Preparation method of 3- (substituted/unsubstituted phenyl) -3-hydroxy-propionyl hydroxamic acid 吉首大学 2021-01-15 CN disclosed