SCHEMBL28878178

SCHEMBL28878178

CC(CCO)Cc1c[nH]c2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.67
ADRB1 P08588 1/20 0.67
HTR1A P08908 1/20 0.67
ADRA2A P08913 1/20 0.67
SLC6A2 P23975 1/20 0.67
HTR1D P28221 1/20 0.67
HTR1B P28222 1/20 0.67
HTR2C P28335 1/20 0.67
HTR1E P28566 1/20 0.67
SLC6A4 P31645 1/20 0.67
HTR7 P34969 1/20 0.67
HTR2B P41595 1/20 0.67
HTR6 P50406 1/20 0.67
SLC6A3 Q01959 1/20 0.67
MAPT P10636 3/20 0.60
KDM4E B2RXH2 3/20 0.60
POLB P06746 2/20 0.60
APAF1 O14727 1/20 0.60
RECQL P46063 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL1911320 0.87 HTR2A (0.66) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL14472913 0.87 HTR2A (0.66) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL357990 0.87 HTR2A (0.66) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL15344197 0.87 HTR2A (0.66) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL20444122 0.83 HTR2A (0.60) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL22803428 0.82 HTR2A (0.69) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL360064 0.82 HTR2A (0.69) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL8246556 0.82 HTR2A (0.69) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL14473032 0.82 HTR2A (0.69) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL24690053 0.81 HTR2A (0.55) HTR2AADRB1HTR1AADRA2ASLC6A2

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-110382685-A For improving the biology and method of the expression plum surprise yeast xylose transport albumen of xylose absorption 创新生物科学公司 2019-10-25 CN disclosed
CN-110325640-A Plum surprise yeast kind for compound biosynthesis 创新生物科学公司 2019-10-11 CN disclosed