SCHEMBL6932576

SCHEMBL6932576

OC(Cc1ccc(F)c(Oc2ccccc2)c1)/C(F)=C(/c1ccc(Cl)cc1)C1CC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.35
PPARG P37231 4/20 0.35
LPAR1 Q92633 6/20 0.35
LPAR5 Q9H1C0 6/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
LTA4H P09960 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL6932578 1.00 PPARA (0.35) PPARAPPARGLPAR1LPAR5L3MBTL1
SCHEMBL6935483 0.89 MAPK14 (0.39) LPAR1LPAR5SMN1; SMN2HPGDLTA4H
SCHEMBL6935487 0.89 MAPK14 (0.39) LPAR1LPAR5SMN1; SMN2HPGDLTA4H
SCHEMBL8418431 0.83 SRD5A2 (0.38) LPAR1LPAR5L3MBTL1LMNASMN1; SMN2
SCHEMBL7860917 0.81 TTR (0.31) LPAR1LPAR5
SCHEMBL7860919 0.81 LPAR1 (0.33) LPAR1LPAR5
SCHEMBL7860916 0.81 DRD4 (0.32)
SCHEMBL6932505 0.73 LMNA (0.35) L3MBTL1LMNASMN1; SMN2
SCHEMBL6935659 0.73 LMNA (0.35) L3MBTL1LMNASMN1; SMN2
SCHEMBL6230685 0.72 LMNA (0.34) L3MBTL1LMNASMN1; SMN2GAAPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1131273-B1 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 BASF AG (DE) 2003-10-22 EP claimed
US-6342642-B1 DEHYDROXYLATION OF HALOBUTENOL COMPOUNDS TO FORM BUTADIENES BASF AKTIENGESELLSCHAFT (DE) 2002-01-29 US claimed
EP-1202948-B1 PROCESSES FOR THE PREPARATION OF 2-ARYLVINYL ALKYL ETHER AND 1,4-DIARYL-2-FLUORO-2-BUTENE COMPOUNDS BASF AG (DE) 2003-12-10 EP disclosed
EP-1131273-B1 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 BASF AG (DE) 2003-10-22 EP disclosed
US-6342642-B1 DEHYDROXYLATION OF HALOBUTENOL COMPOUNDS TO FORM BUTADIENES BASF AKTIENGESELLSCHAFT (DE) 2002-01-29 US disclosed
US-6291721-B1 REACTING 2-ARYL ALDEHYDE COMPOUND WITH ALCOHOL OR HEATING ACETAL COMPOUND IN PRESENCE OF APROTIC SOLVENT TO PRODUCE2-ARYLVINYL ETHER COMPOUND AMERICAN CYANAMID CO. 2001-09-18 US disclosed