SCHEMBL28048068

SCHEMBL28048068

CNCC(C=O)c1cccc(O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.61
ADRB1 P08588 2/20 0.61
ADRA1A P35348 2/20 0.61
HTR1A P08908 2/20 0.61
ADRB2 P07550 1/20 0.61
ADRA2A P08913 1/20 0.61
ADRB3 P13945 1/20 0.61
TSHR P16473 1/20 0.61
ADRA2B P18089 1/20 0.61
ADRA2C P18825 1/20 0.61
NFKB1 P19838 1/20 0.61
DRD1 P21728 1/20 0.61
HTR7 P34969 1/20 0.61
ADRA1B P35368 1/20 0.61
DRD3 P35462 1/20 0.61
RAB9A P51151 1/20 0.61
SLC6A3 Q01959 1/20 0.61
LMNA P02545 3/20 0.59
KDM4E B2RXH2 2/20 0.59
BLM P54132 2/20 0.59

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
SCHEMBL9714681 0.81 HIF1A (0.50) HIF1AADRB1ADRA1AHTR1AADRB2
SCHEMBL28292762 0.79 TAAR1 (0.52) SLC6A3KDM4EHTR2AKMT2ATAAR1
SCHEMBL31038339 0.78 CHRM2 (0.50) KDM4ETDP1
SCHEMBL15652787 0.78 KYNU (0.44) HIF1AADRB1ADRA1AHTR1AADRB2
Phenylephrine SCHEMBL4712 0.76 HIF1A (1.00) HIF1AADRB1ADRA1AHTR1AADRB2
Phenylephrine SCHEMBL29382851 0.76 HIF1A (1.00) HIF1AADRB1ADRA1AHTR1AADRB2
Phenylephrine SCHEMBL29392606 0.76 HIF1A (1.00) HIF1AADRB1ADRA1AHTR1AADRB2
Phenylephrine SCHEMBL895602 0.76 HIF1A (1.00) HIF1AADRB1ADRA1AHTR1AADRB2
Phenylephrine SCHEMBL29374674 0.76 HIF1A (1.00) HIF1AADRB1ADRA1AHTR1AADRB2
SCHEMBL13955274 0.76 HIF1A (0.69) HIF1AADRB1ADRA1AHTR1AADRB2

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
CN-106324794-A Chip automatic focusing apparatus of gene spectrum sequencing device and focusing method thereof 徐州工程学院 2017-01-11 CN disclosed
CN-105238768-A Short-chain dehydrogenase, gene of short-chain dehydrogenase, recombinant expression vector, genetically engineered bacterium and application UNIV ZHEJIANG 2016-01-13 CN disclosed