SCHEMBL7790045

SCHEMBL7790045

COCOc1cc2c(cc1-c1cc(-c3ccc(C(=O)O)cc3)ccc1OS(=O)(=O)C(F)(F)F)C(C)(C)CCC2(C)C

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RARG P13631 17/20 0.56
RARB P10826 10/20 0.56
RARA P10276 9/20 0.56
RXRA P19793 3/20 0.48
EGFR P00533 1/20 0.48
HNF4A P41235 1/20 0.47

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
SCHEMBL5847730 0.91 RARG (0.46) RARGRARBRARARXRAEGFR
SCHEMBL7790069 0.86 RARG (0.67) RARGRARBRARARXRA
SCHEMBL3679095 0.84 RARG (0.71) RARGRARBRARARXRA
SCHEMBL7784249 0.84 RARG (0.62) RARGRARBRARARXRAEGFR
SCHEMBL7789667 0.83 RARB (0.66) RARGRARBRARARXRAHNF4A
SCHEMBL2918656 0.82 EGFR (0.67) RARGRARBRARARXRAEGFR
SCHEMBL5846380 0.78 RARG (0.78) RARGRARBRARARXRA
SCHEMBL5847370 0.78 RARG (0.53) RARGRARBRARARXRA
SCHEMBL5846356 0.77 RARG (0.61) RARGRARBRARARXRA
SCHEMBL497952 0.75 RARG (0.56) RARGRARBRARARXRA

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-0952974-B1 BIPHENYL DERIVATIVES SUBSTITUTED BY AN AROMATIC OR HETEROAROMATIC RADICAL AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2001-11-21 EP disclosed