SCHEMBL11249699

SCHEMBL11249699

O=CCCCCCCCCCCCCCCC(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
HIF1A Q16665 1/20 0.45
FAAH O00519 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
OXER1 Q8TDS5 1/20 0.33
ALOX5 P09917 1/20 0.32
ACLY P53396 1/20 0.31
ALOX15 P16050 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
SCHEMBL8664329 1.00 TSHR (0.46) TSHRHIF1AFAAHTRPV1OXER1
SCHEMBL848730 1.00 TSHR (0.46) TSHRHIF1AFAAHTRPV1OXER1
SCHEMBL2486224 1.00 TSHR (0.46) TSHRHIF1AFAAHTRPV1OXER1
SCHEMBL835618 0.97 HIF1A (0.47) TSHRHIF1AFAAHTRPV1OXER1
SCHEMBL693531 0.89
SCHEMBL16104757 0.80 TSHR (0.48) TSHRHIF1AFAAHTRPV1ACLY
SCHEMBL10546638 0.80 TSHR (0.42) TSHRHIF1AFAAHTRPV1
SCHEMBL848156 0.80 TSHR (0.42) TSHRHIF1AFAAHTRPV1
SCHEMBL19554091 0.80 TSHR (0.42) TSHRHIF1AFAAHTRPV1
SCHEMBL285606 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4318914-A Hypolipidemic and antiatherosclerotic 4-(polyfluoro-alkylamino)phenyl compounds AMERICAN CYANAMID COMPANY (US) 1982-03-09 US disclosed
US-4310545-A Hypolipidemic and antiatherosclerotic 4-(polyfluoroalkylamino) phenyl compounds AMERICAN CYANAMID COMPANY (US) 1982-01-12 US disclosed
US-4305959-A Hypolipidemic and antiatherosclerotic 4-(polyfluoro-alkylamino)phenyl compounds AMERICAN CYANAMID COMPANY (US) 1981-12-15 US disclosed
US-4205085-A Hypolipidemic and antiatherosclerotic 4-(polyfluoroalkylamino)phenyl compounds AMERICAN CYANAMID COMPANY (US) 1980-05-27 US disclosed
EP-0003663-A2 Amino-substituted phenyl and heteroaryl compounds, process for their preparation and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-08-22 EP disclosed