SCHEMBL382486

SCHEMBL382486

CCCCc1cc(C(=O)O)ccc1-c1ccc(OCCO)c(-c2ccc(N3CCCC3)c(Cl)c2)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARG P13631 17/20 0.59
RARB P10826 16/20 0.59
RARA P10276 15/20 0.59
PPARD Q03181 1/20 0.43
PTPN11 Q06124 1/20 0.40

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
SCHEMBL382115 0.89 RARG (0.55) RARGRARBRARAPTPN11
SCHEMBL382470 0.80 RARG (0.68) RARGRARBRARAPTPN11
SCHEMBL383178 0.80 RARG (0.75) RARGRARBRARAPTPN11
SCHEMBL382116 0.79 RARG (0.57) RARGRARBRARAPTPN11
Trifarotene SCHEMBL381493 0.74 RARG (1.00) RARGRARBRARA
SCHEMBL383283 0.74 RARG (0.73) RARGRARBRARA
SCHEMBL27337675 0.74 RARG (0.73) RARGRARBRARA
SCHEMBL382479 0.74 RARG (1.00) RARGRARBRARA
SCHEMBL27159554 0.74 RARG (0.74) RARGRARBRARAPTPN11
SCHEMBL27337963 0.74 RARG (0.77) RARGRARBRARAPTPN11

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 disclosed