SCHEMBL9810139

SCHEMBL9810139

CCCCC(Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1)(C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 8/20 0.39
RXRB P28702 8/20 0.39
RXRG P48443 6/20 0.39
NR5A2 O00482 1/20 0.36
NR5A1 Q13285 1/20 0.36
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
HDAC3 O15379 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
SLC13A5 Q86YT5 2/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
CYP3A4 P08684 2/20 0.33
MAPT P10636 2/20 0.33
ALOX15 P16050 2/20 0.33

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
SCHEMBL14508866 0.90 TP53 (0.37) RXRARXRBRXRGNR5A2NR5A1
SCHEMBL462662 0.82 ALDH1A1 (0.49) NR5A2NR5A1ALDH1A1LMNACYP3A4
SCHEMBL28133552 0.78 RXRA (0.40) RXRARXRBRXRGHDAC3HDAC1
SCHEMBL1719554 0.77 NR5A2 (0.48) RXRANR5A2NR5A1ALDH1A1LMNA
SCHEMBL28003878 0.77 SMN1; SMN2 (0.47) ALDH1A1LMNATDP1SMN1; SMN2MEN1
SCHEMBL7212876 0.76 CYP1A2 (0.42) RXRARXRBHDAC2HDAC8CYP1A2
SCHEMBL27594317 0.75 ALDH1A1 (0.41) ALDH1A1LMNASLC13A5ESR1ESR2
SCHEMBL1487540 0.74 BLM (0.51) ALDH1A1LMNAESR1ESR2CYP3A4
SCHEMBL3184779 0.73 SLC13A5 (0.43) RXRARXRBRXRGHDAC3HDAC1
SCHEMBL28987895 0.73 RXRA (0.45) RXRARXRBRXRGLMNASLC13A5

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-5030243-A Applying to a polyamide/polyurethane web an aqueous liquid containing a 2,6-dimethyl-2,6-dialkylpiperidin-4-yl ether, ester or similar derivative CIBA-GEIGY CORPORATION (US) 1991-07-09 US disclosed