SCHEMBL8480665

SCHEMBL8480665

CC(C)(CCc1ccc(-c2ccc(Cl)cc2)cc1)CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC13A5 Q86YT5 4/20 0.50
TSHR P16473 1/20 0.48
MIF P14174 1/20 0.45
TBXA2R P21731 2/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
LPAR1 Q92633 1/20 0.43
CTRC Q99895 1/20 0.43
MAOB P27338 1/20 0.42
FFAR1 O14842 1/20 0.42
CPT2 P23786 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CNR1 P21554 1/20 0.42

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
SCHEMBL11829849 0.81 SLC13A5 (0.49) SLC13A5RXRARXRBRXRGMAOB
SCHEMBL13870219 0.80 SLC13A5 (0.50) SLC13A5FFAR1CPT2TDP1
SCHEMBL7450180 0.80 SLC13A5 (0.50) SLC13A5FFAR1CPT2TDP1
SCHEMBL8834980 0.79 SLC13A5 (0.49) SLC13A5TBXA2RFFAR1CPT2TDP1
SCHEMBL13778188 0.79 SLC13A5 (0.69) SLC13A5RXRARXRBRXRGFFAR1
SCHEMBL17590423 0.78 TBXA2R (0.54) TSHRMIFTBXA2R
SCHEMBL8834821 0.78 TBXA2R (0.47) SLC13A5TSHRTBXA2RFFAR1CPT2
SCHEMBL11203493 0.76 FFAR1 (0.51) SLC13A5TBXA2RFFAR1
SCHEMBL11823331 0.76 MIF (0.46) SLC13A5TSHRMIFTBXA2RFFAR1
SCHEMBL25353036 0.75 FFAR1 (0.64) SLC13A5FFAR1CPT2TDP1

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
US-5874473-A OSTEOPOROSIS; ANTIARTHRITIC AGENTS BAYER CORPORATION (US) 1999-02-23 US disclosed