SCHEMBL6152124

SCHEMBL6152124

O=C(O)Cc1cc(-c2cccc(OCC=Cc3ccc(C(F)(F)F)cc3)c2)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 7/20 0.41
PPARG P37231 3/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
PSEN1 P49768 1/20 0.41
S1PR5 Q9H228 3/20 0.40
DDR1 Q08345 1/20 0.39
PPARA Q07869 5/20 0.39
BCL2L1 Q07817 1/20 0.39
MCL1 Q07820 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
THRB P10828 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
RXRA P19793 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38

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
SCHEMBL6152122 1.00 PPARD (0.41) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580642 0.89 PTGER2 (0.41) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580639 0.89 PTGER2 (0.41) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580638 0.87 PTGES (0.44) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580635 0.87 PTGES (0.44) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580731 0.86 PSEN1 (0.47) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580734 0.86 PSEN1 (0.47) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580428 0.85 RXRA (0.46) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580432 0.85 RXRA (0.46) PPARDPPARGPTGESALOX5PSEN1
SCHEMBL5580472 0.83 PTGES (0.41) PPARDPPARGPTGESALOX5PSEN1

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-1604971-A1 CINNAMYL ALCOHOL DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2005-12-14 EP disclosed