SCHEMBL11245962

SCHEMBL11245962

CCCCCC[CH]CCCCCCCCCCC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
CES2 O00748 2/20 0.41
LPAR1 Q92633 1/20 0.41
LPAR3 Q9UBY5 1/20 0.41
FAAH O00519 9/20 0.40
CES1 P23141 5/20 0.40
TRPV1 Q8NER1 1/20 0.37
THRB P10828 1/20 0.36
PLA2G4A P47712 1/20 0.36
DNM1 Q05193 3/20 0.35

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
SCHEMBL10447727 0.93 FAAH (0.41) TSHRCES2FAAHCES1PLA2G4A
SCHEMBL24938544 0.86 FAAH (0.53) FAAHCES1TRPV1PLA2G4A
SCHEMBL28417663 0.86 FAAH (0.53) FAAHCES1TRPV1PLA2G4A
SCHEMBL11244957 0.86 PTPN7 (0.36) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL11245966 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL24234728 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL6934289 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL83980 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL465782 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH
SCHEMBL23034519 0.85 CES2 (0.50) TSHRCES2LPAR1LPAR3FAAH

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
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 claimed
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