SCHEMBL6277682

SCHEMBL6277682

CCOc1cc(-c2ccccc2)ccc1CC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.51
RXRB P28702 2/20 0.51
RXRG P48443 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.49
GLA P06280 1/20 0.49
CFD P00746 2/20 0.47
F11 P03951 2/20 0.47
TPSB2 P20231 2/20 0.47
PLG P00747 1/20 0.47
PLAU P00749 1/20 0.47
KLKB1 P03952 1/20 0.47
F7 P08709 1/20 0.47
PTGS1 P23219 2/20 0.47
ABCC4 O15439 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
CAMK2A Q9UQM7 1/20 0.46
HDAC1 Q13547 1/20 0.45

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
SCHEMBL25913045 0.87 L3MBTL1 (0.49) RXRARXRBRXRGL3MBTL1LMNA
SCHEMBL11839396 0.85 CFD (0.47) CFDF11TPSB2PLGPLAU
SCHEMBL5036095 0.84 NR1H4 (0.52) CFDF11TPSB2PLGPLAU
SCHEMBL1628791 0.80 L3MBTL1 (0.62) L3MBTL1GLACFDF11TPSB2
SCHEMBL21939140 0.80 SRC (0.53) RXRARXRBRXRGL3MBTL1GLA
SCHEMBL28063443 0.80 KDM4E (0.51) RXRARXRBL3MBTL1LMNAHDAC1
Hydrochloric Acid SCHEMBL2525349 0.79 L3MBTL1 (0.61) L3MBTL1GLACFDF11TPSB2
SCHEMBL21900449 0.78 CHRM1 (0.51) L3MBTL1GLAGAATSHRCAMK2A
SCHEMBL6498950 0.78 ADRB3 (0.60) RXRARXRBL3MBTL1GLALMNA
SCHEMBL29844957 0.78 THRB (0.47) RXRARXRBRXRGL3MBTL1GLA

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
WO-2005092062-A2 COMPOUNDS FOR NEURODEGENERATIVE DISORDERS MYRIAD GENETICS, INC. (US) 2005-10-06 WO disclosed