SCHEMBL7019245

SCHEMBL7019245

CC1(C)C[C@@](C)(c2ccc(C(=O)O)cc2)c2ccc(OC(=O)O)cc21

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.52
RXRB P28702 9/20 0.52
RXRG P48443 7/20 0.52
RARB P10826 5/20 0.48
RARG P13631 5/20 0.48
CYP26A1 O43174 4/20 0.45
CYP26B1 Q9NR63 3/20 0.45
CYP3A4 P08684 2/20 0.44
HNF4A P41235 1/20 0.43
RARA P10276 3/20 0.43
CRABP2 P29373 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
SCHEMBL9149973 0.88 RXRA (0.43) RXRARXRBRXRGRARBRARG
SCHEMBL7019242 0.86 RXRA (0.55) RXRARXRBRXRGRARBRARG
SCHEMBL9817816 0.80 RXRA (0.55) RXRARXRBRXRGRARBRARG
SCHEMBL527839 0.80 RXRA (0.55) RXRARXRBRXRGRARBRARG
SCHEMBL29565418 0.80 RXRA (0.55) RXRARXRBRXRGRARBRARG
SCHEMBL9523050 0.80 RXRA (0.50) RXRARXRBRXRGRARBRARG
SCHEMBL17281437 0.79 RXRA (0.49) RXRARXRBRXRGRARBRARG
Ethylene SCHEMBL9717516 0.78 RXRA (0.54) RXRARXRBRXRGRARBRARG
Isophthalic Acid SCHEMBL8673837 0.76 RXRA (0.50) RXRARXRBRXRGRARBRARG
SCHEMBL17285601 0.75 RXRA (0.42) RXRARXRBRXRGRARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0856025-B1 CHOLESTERIC PHASE-FORMING POLYMERS AND THEIR USE CELANESE VENTURES GMBH (DE) 2003-01-15 EP disclosed
EP-0856025-A1 CHOLESTERIC PHASE-FORMING POLYMERS, PROCESS FOR THEIR PREPARATION AND THEIR USE Hoechst Research & Technology Deutschland GmbH & Co. KG (DE) 1998-08-05 EP disclosed
WO-1997014739-A1 CHOLESTERIC PHASE-FORMING POLYMERS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST RESEARCH & TECHNOLOGY (DE) 1997-04-24 WO disclosed