SCHEMBL28036337

SCHEMBL28036337

CCCCCOc1ccccc1C(C)C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.50
CYSLTR1 Q9Y271 2/20 0.50
PPARG P37231 6/20 0.49
LMNA P02545 2/20 0.47
MEN1 O00255 2/20 0.47
CYP3A4 P08684 2/20 0.47
KMT2A Q03164 2/20 0.47
NR1I2 O75469 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRA2A P08913 1/20 0.47
MAPT P10636 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR2B P41595 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
ALDH1A1 P00352 1/20 0.46
PPARA Q07869 2/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 2/20 0.44

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
SCHEMBL28036403 0.98 CYSLTR2 (0.52) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL10693475 0.95 CYP1A2 (0.49) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL11734033 0.82 CYSLTR2 (0.51) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL29033404 0.81 PPARG (0.58) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL9214705 0.80 LMNA (0.61) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL24893443 0.79 L3MBTL1 (0.65) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL27842200 0.79 HTR2C (0.39) LMNAMEN1CYP3A4KMT2AALDH1A1
SCHEMBL28036336 0.78 CYSLTR2 (0.56) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL9414549 0.78 CYSLTR2 (0.52) CYSLTR2CYSLTR1PPARGLMNAMEN1
SCHEMBL1165782 0.77 CYSLTR2 (0.59) CYSLTR2CYSLTR1PPARGLMNAMEN1

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-104981452-A Skin whitening agent containing novel cyclic compound RNS CO LTD 2015-10-14 CN disclosed