SCHEMBL7860917

SCHEMBL7860917

Cc1cc(F)c(C(=C(F)C(O)Cc2ccc(F)c(Oc3ccccc3)c2)C2CC2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.31
LPAR1 Q92633 2/20 0.30
LPAR5 Q9H1C0 2/20 0.30
DRD4 P21917 1/20 0.30

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
SCHEMBL7860916 0.83 DRD4 (0.32) TTRDRD4
SCHEMBL6932578 0.81 PPARA (0.35) LPAR1LPAR5
SCHEMBL6932576 0.81 PPARA (0.35) LPAR1LPAR5
SCHEMBL6935483 0.79 MAPK14 (0.39) LPAR1LPAR5
SCHEMBL6935487 0.79 MAPK14 (0.39) LPAR1LPAR5
SCHEMBL7860919 0.78 LPAR1 (0.33) LPAR1LPAR5
SCHEMBL7862126 0.76 SMN1; SMN2 (0.32) TTR
SCHEMBL8418431 0.66 SRD5A2 (0.38) LPAR1LPAR5
SCHEMBL13888115 0.66 TTR (0.47) TTRLPAR1LPAR5
SCHEMBL11091463 0.65 TTR (0.39) TTRLPAR1LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131273-A1 1,4-DIARYL-2-FLUORO-1-BUTEN-3-OL COMPOUNDS AND THEIR USE IN THE PREPARATION OF 1,4-DIARYL-2-FLUORO-1,3-BUTADIENE AND 1,4-DIARYL-2-FLUORO-2-BUTENE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 2001-09-12 EP claimed
WO-2000029362-A1 1,4-DIARYL-2-FLUORO-1-BUTEN-3-OL COMPOUNDS AND THEIR USE IN THE PREPARATION OF 1,4-DIARYL-2-FLUORO-1,3-BUTADIENE AND 1,4-DIARYL-2-FLUORO-2-BUTENE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 2000-05-25 WO claimed
EP-1131273-A1 1,4-DIARYL-2-FLUORO-1-BUTEN-3-OL COMPOUNDS AND THEIR USE IN THE PREPARATION OF 1,4-DIARYL-2-FLUORO-1,3-BUTADIENE AND 1,4-DIARYL-2-FLUORO-2-BUTENE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 2001-09-12 EP disclosed
WO-2000029362-A1 1,4-DIARYL-2-FLUORO-1-BUTEN-3-OL COMPOUNDS AND THEIR USE IN THE PREPARATION OF 1,4-DIARYL-2-FLUORO-1,3-BUTADIENE AND 1,4-DIARYL-2-FLUORO-2-BUTENE COMPOUNDS AMERICAN CYANAMID COMPANY (US) 2000-05-25 WO disclosed