SCHEMBL11247809

SCHEMBL11247809

CCOC(=O)CNC(=O)c1ccc(NCCCCCCCCCCCCCCCC(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.58
RAB9A P51151 4/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
POLB P06746 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
MLYCD O95822 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
PLK1 P53350 3/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL11071146 0.89 NPC1 (0.55) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL11181333 0.88 NPC1 (0.54) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL10788677 0.86 NPC1 (0.52) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL11399221 0.86 NPC1 (0.52) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL11247840 0.85 POLB (0.45) NPC1RAB9ASMN1; SMN2POLBMEN1
SCHEMBL11254051 0.84 PDK1 (0.52) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL11251807 0.84 KDM4E (0.48) POLBMLYCDKDM4EPLK1
SCHEMBL11244265 0.81 MAPT (0.53) SMN1; SMN2POLBTP53MEN1KMT2A
SCHEMBL11493042 0.81 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL11493048 0.81 NPC1 (0.50) NPC1RAB9ASMN1; SMN2POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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