SCHEMBL6557441

SCHEMBL6557441

CCCCCc1ccc(-c2cc(F)c(F)c(F)c2C(=O)O)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.62
RARA P10276 2/20 0.59
RARG P13631 1/20 0.59
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
MAPT P10636 1/20 0.52
MTOR P42345 1/20 0.52
KMT2A Q03164 1/20 0.52
PLK1 P53350 3/20 0.49
PLK3 Q9H4B4 2/20 0.49
DHODH Q02127 1/20 0.49
MPL P40238 1/20 0.47
EP300 Q09472 1/20 0.45
KAT5 Q92993 1/20 0.45
KAT8 Q9H7Z6 1/20 0.45

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
SCHEMBL6557444 0.81 RARB (0.55) RARBRARARARGALDH1A1MEN1
SCHEMBL9913190 0.81 RARB (0.72) RARBRARARARGALDH1A1MEN1
SCHEMBL5685909 0.80 RARB (0.71) RARBRARARARGALDH1A1MEN1
SCHEMBL9494490 0.78 RARB (0.62) RARBRARARARGALDH1A1MEN1
SCHEMBL10340873 0.78 RARB (0.67) RARBRARARARGALDH1A1MEN1
SCHEMBL8025722 0.78 RARB (0.74) RARBRARARARGALDH1A1MEN1
SCHEMBL28196075 0.77 RARB (0.97) RARBRARARARGALDH1A1MEN1
SCHEMBL9764072 0.77 RARB (0.50) RARBRARARARGALDH1A1MEN1
SCHEMBL9764331 0.76 RARB (0.52) RARBRARARARGALDH1A1MEN1
SCHEMBL9763731 0.76 RARB (0.52) RARBRARARARGALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1223209-B1 Fluorinated fluorenes and use thereof in liquid crystal mixtures CLARIANT INT LTD (CH) 2004-03-03 EP disclosed
EP-1223209-A1 Fluorinated fluorenes and use thereof in liquid crystal mixtures CLARIANT INTERNATIONAL LTD. (CH) 2002-07-17 EP disclosed