SCHEMBL382222

SCHEMBL382222

CC(=O)OCCOc1ccc(-c2ccc(OC(=O)O)cc2)cc1-c1ccc(N2CCCC2)c(C(C)(C)C)c1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARG P13631 13/20 0.66
RARA P10276 12/20 0.66
RARB P10826 12/20 0.66
SLC6A9 P48067 2/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
PPARG P37231 1/20 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
SCHEMBL382688 0.91 RARG (0.64) RARGRARARARBSLC6A9PPARG
SCHEMBL383438 0.90 RARG (0.78) RARGRARARARBSLC6A9
SCHEMBL382029 0.89 RARG (0.83) RARGRARARARB
SCHEMBL382310 0.89 RARG (0.80) RARGRARARARBSLC6A9
SCHEMBL25747751 0.89 RARG (0.68) RARGRARARARBSLC6A9MEN1
SCHEMBL382355 0.89 RARG (0.80) RARGRARARARBSLC6A9
SCHEMBL25747756 0.88 RARG (0.72) RARGRARARARBSLC6A9
SCHEMBL25040287 0.87 RARG (0.70) RARGRARARARBSLC6A9GAA
SCHEMBL25038342 0.86 RARG (0.64) RARGRARARARBGAAMAPT
SCHEMBL30244992 0.86 RARG (0.64) RARGRARARARBGAAMAPT

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
EP-1831149-B1 NOVEL LIGANDS THAT MODULATE RAR RECEPTORS AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2012-01-25 EP claimed