SCHEMBL27691695

SCHEMBL27691695

CC(C=O)c1ccc(O)c(F)c1O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 2/20 0.38
▸ ADRB1 P08588 2/20 0.38
▸ ADRB3 P13945 2/20 0.38
▸ ADRA2A P08913 3/20 0.37
▸ ADRA2B P18089 3/20 0.37
▸ ADRA2C P18825 3/20 0.37
▸ ADRA1A P35348 2/20 0.37
▸ ADRA1B P35368 1/20 0.37
▸ RNASEH1 O60930 1/20 0.31
▸ TYR P14679 1/20 0.30

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
SCHEMBL27689600 0.80 ADRB2 (0.34) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL19249192 0.78 GABRA1 (0.50) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL27691527 0.78 ERN1 (0.32) RNASEH1TYR
SCHEMBL27691522 0.78 MAPK1 (0.34) RNASEH1TYR
SCHEMBL27711676 0.77 — —
SCHEMBL27691694 0.76 ADRB2 (0.39) ADRB2ADRB1ADRB3ADRA2AADRA2B
SCHEMBL27798051 0.74 CA3 (0.38) RNASEH1TYR
SCHEMBL27798056 0.74 CA3 (0.42) ADRA1ATYR
SCHEMBL28177274 0.73 ERN1 (0.45) TYR
SCHEMBL27641337 0.73 HSP90AB1 (0.35) ADRB2ADRB1

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-101061105-A Potentiators of glutamate receptors LILLY CO ELI (US) 2007-10-24 — — CN disclosed
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