SCHEMBL28859486

SCHEMBL28859486

CC(C)(C)C(O)C[Se]c1c[nH]c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.41
FFAR1 O14842 2/20 0.41
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
HTR2B P41595 2/20 0.38
ADRB1 P08588 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
HTR1E P28566 1/20 0.38
SLC6A4 P31645 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
SLC6A3 Q01959 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 3/20 0.38

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
SCHEMBL28214833 0.81 GPR84 (0.47) GPR84FFAR1ATMSMN1; SMN2HTR2A
SCHEMBL28214828 0.80 ATM (0.42) GPR84ATMHTR2AHTR2CHTR2B
SCHEMBL14663993 0.74 HTR2A (0.59) GPR84SMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL28919212 0.71 GPR84 (0.47) GPR84ATMHTR2AHTR2CHTR2B
SCHEMBL29543152 0.68 GPR84 (0.61) GPR84FFAR1ATMHTR2AHTR2C
SCHEMBL28907736 0.67 ATM (0.52) GPR84FFAR1ATMHTR2AHTR2C
SCHEMBL11526080 0.67 ATM (0.52) GPR84FFAR1ATMHTR2AHTR2C
SCHEMBL24145251 0.64 GPR84 (0.65) GPR84FFAR1ATMSMN1; SMN2HTR2A
SCHEMBL13789952 0.64 GPR84 (0.65) GPR84FFAR1ATMSMN1; SMN2HTR2A
SCHEMBL28780556 0.64 MAPK1 (0.46) GPR84FFAR1ATMHTR2AHTR2C

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-108047118-A The synthetic method of 3- indoles seleno alcohols organic compounds 温州大学苍南研究院 2018-05-18 CN disclosed