SCHEMBL8459307

SCHEMBL8459307

Cc1ccc(OCc2ccc(C(=O)O)cc2)c(C(C)(C)C)c1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.69
RXRB P28702 9/20 0.69
RXRG P48443 7/20 0.69
MRGPRX4 Q96LA9 7/20 0.60
NR4A2 P43354 1/20 0.53
HPGD P15428 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
FOLH1 Q04609 1/20 0.51

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
SCHEMBL8460355 0.86 RXRA (0.74) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL8458553 0.84 RXRA (0.65) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL5030365 0.83 RXRA (0.72) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL3237142 0.83 MRGPRX4 (0.54) RXRARXRBRXRGMRGPRX4SMN1; SMN2
SCHEMBL7766099 0.82 WDR5 (0.47) RXRARXRBRXRGMRGPRX4NPC1
SCHEMBL6238028 0.82 RXRA (1.00) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL8460108 0.80 RXRA (0.76) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL8461702 0.78 RXRA (0.70) RXRARXRBRXRGMRGPRX4NR4A2
SCHEMBL5321778 0.77 PTGDR2 (0.70) MRGPRX4SMN1; SMN2
SCHEMBL8908814 0.77 RXRA (0.63) RXRARXRBRXRGMRGPRX4HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999048529-A1 RETINOID-GLITAZONE COMBINATIONS WARNER-LAMBERT COMPANY (US) 1999-09-30 WO disclosed
EP-0808159-A1 USE OR RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1997-11-26 EP disclosed
WO-1996024344-A1 USE OF RETINOIDS TO LOWER PLASMA LEVELS OF LIPOPROTEIN (a) WARNER-LAMBERT COMPANY (US) 1996-08-15 WO disclosed
US-5489611-A ADMINISTERING A RETINOID COMPOUND WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed