SCHEMBL10646337

SCHEMBL10646337

CCCCOC(=O)C(C)Oc1ccc2ccc(Oc3ccc(C(F)(F)F)cc3Cl)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.49
PPARD Q03181 2/20 0.45
PPARA Q07869 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TTR P02766 1/20 0.44
PPOX P50336 1/20 0.44
PPARG P37231 1/20 0.43
HTR2A P28223 2/20 0.40
SLC6A4 P31645 2/20 0.40
KCNH2 Q12809 2/20 0.40
MRGPRX4 Q96LA9 2/20 0.40
GAA P10253 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39

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
SCHEMBL10643426 1.00 FFAR1 (0.49) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10643331 0.95 FFAR1 (0.50) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10644002 0.95 FFAR1 (0.50) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10643290 0.92 FFAR1 (0.48) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10344713 0.92 FFAR1 (0.55) FFAR1PPARDPPARATDP1MEN1
SCHEMBL9633459 0.91 FFAR1 (0.52) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10644204 0.91 FFAR1 (0.52) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10644057 0.90 TDP1 (0.51) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10643788 0.90 TDP1 (0.51) FFAR1PPARDPPARATDP1MEN1
SCHEMBL10643355 0.90 FFAR1 (0.49) FFAR1PPARDPPARATDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0179015-B1 7-(ARYLOXY)-2-NAPHTHOXYALKANECARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION OF THESE COMPOUNDS, AS WELL AS AGENTS HAVING HERBICIDAL ACTIVITY CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1988-04-13 EP claimed
US-4709077-A 7-(aryloxy)-2-naphthoxyalkanecarboxylic acid derivatives, processes for the preparation of these compounds, as well as agents having herbicidal activity containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1987-11-24 US claimed
EP-0179015-A1 7-(Aryloxy)-2-naphthoxyalkanecarboxylic acid derivatives, processes for the preparation of these compounds, as well as agents having herbicidal activity containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1986-04-23 EP claimed