SCHEMBL19622014

SCHEMBL19622014

CCCCCc1ccc(OC(=O)c2ccc3c(c2F)C(F)(F)Cc2c-3ccc(CCC)c2F)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.35
PPARG P37231 1/20 0.35
RARB P10826 3/20 0.35
RARA P10276 1/20 0.35
RARG P13631 1/20 0.35
S1PR1 P21453 1/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.32
FAAH O00519 1/20 0.31
KAT8 Q9H7Z6 2/20 0.31

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
SCHEMBL10019674 0.87 PPARA (0.39) PPARAPPARGRARBRARARARG
SCHEMBL19621957 0.82 S1PR1 (0.36) RARBRARARARGS1PR1
SCHEMBL19622140 0.81 CTSL (0.32)
SCHEMBL10019873 0.80 RARB (0.40) PPARAPPARGRARBRARARARG
SCHEMBL10019691 0.78 PPARA (0.39) PPARAPPARGRARBRARARARG
SCHEMBL10019655 0.78 CTSL (0.31)
SCHEMBL10381663 0.76 RARB (0.47) PPARAPPARGRARBRARARARG
SCHEMBL10019362 0.76 ELANE (0.35) PPARAPPARGRARBRARARARG
SCHEMBL19622009 0.76
SCHEMBL10382229 0.75 RARB (0.49) PPARAPPARGRARBRARARARG

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-2669263-B1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-22 EP disclosed