SCHEMBL370658

SCHEMBL370658

CCCc1ccccc1[C@@H](I)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.42
ADRA2B P18089 2/20 0.42
ADRA2C P18825 2/20 0.42
CYSLTR2 Q9NS75 8/20 0.35
CYSLTR1 Q9Y271 8/20 0.35
TSHR P16473 1/20 0.34
HTR1A P08908 1/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
LIPG Q9Y5X9 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31

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
SCHEMBL9621039 0.79 ADRA2A (0.46) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL4843352 0.79 ADRA2A (0.46) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL18377997 0.77 ADRA2A (0.42) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL11200726 0.76 ADRA2A (0.44) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL7643940 0.76 ADRA2A (0.44) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL19254463 0.76 TSHR (0.55) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL872725 0.76 ADRA2A (0.44) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL903364 0.74 CYSLTR2 (0.42) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL10439471 0.74 ADRA2A (0.42) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL14840158 0.74 ADRA2A (0.42) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1

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
EP-2428512-A2 Fluorene compound, light-emitting element, light-emitting device, electronic device and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-03-14 EP disclosed