SCHEMBL28107185

SCHEMBL28107185

O=[C]Cc1c[nH]c2ccc(Cl)cc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.67
HTR2A P28223 4/20 0.64
TRPM8 Q7Z2W7 1/20 0.64
SLC6A4 P31645 3/20 0.52
MTNR1A P48039 1/20 0.52
MTNR1B P49286 1/20 0.52
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP14 P50281 1/20 0.50
F7 P08709 1/20 0.50
F3 P13726 1/20 0.50
GFER P55789 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TSHR P16473 1/20 0.49
IDO1 P14902 1/20 0.49
HTR1A P08908 1/20 0.49
ADRA2A P08913 1/20 0.49
DRD2 P14416 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49

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
SCHEMBL446591 0.83 CSNK2A1 (0.67) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL10119751 0.81 GPR84 (0.73) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL18383117 0.80 GPR84 (1.00) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL949791 0.79 GPR84 (0.76) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL626030 0.78 HTR2A (1.00) GPR84HTR2ATRPM8SLC6A4HSD17B10
SCHEMBL30724496 0.78 HTR2A (1.00) GPR84HTR2ATRPM8SLC6A4HSD17B10
SCHEMBL31567582 0.77 GPR84 (0.73) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL26498347 0.77 GPR84 (0.73) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL1704752 0.77 GPR84 (0.73) GPR84HTR2ATRPM8SLC6A4MTNR1A
SCHEMBL892446 0.77 HTR2A (0.75) GPR84HTR2ATRPM8SLC6A4MTNR1A

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-106119338-A Colpitic test kit of a kind of detection and preparation method thereof 珠海市丽拓发展有限公司 2016-11-16 CN disclosed