SCHEMBL14367154

SCHEMBL14367154

O=C1C(=Nc2c(F)c(F)c(F)c(F)c2F)c2cccc3cccc1c23

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.53
CES2 O00748 1/20 0.53
BCHE P06276 1/20 0.53
CES1 P23141 1/20 0.53
MCL1 Q07820 1/20 0.53
PABPC1 P11940 3/20 0.47
DNMT1 P26358 2/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
CYP3A4 P08684 1/20 0.47
MEN1 O00255 7/20 0.44
KMT2A Q03164 7/20 0.44
MAPT P10636 5/20 0.44
POLB P06746 4/20 0.44
HTT P42858 3/20 0.43
HPGD P15428 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
NR4A1 P22736 1/20 0.43

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
SCHEMBL2231358 0.79 ALDH1A1 (0.53) ALDH1A1CES2BCHECES1MCL1
SCHEMBL2231354 0.79 ALDH1A1 (0.53) ALDH1A1CES2BCHECES1MCL1
SCHEMBL2230200 0.76 MEN1 (0.51) ALDH1A1CES2BCHECES1MCL1
SCHEMBL2230073 0.76 ALDH1A1 (0.48) ALDH1A1CES2BCHECES1MCL1
SCHEMBL2230069 0.76 ALDH1A1 (0.48) ALDH1A1CES2BCHECES1MCL1
SCHEMBL2230195 0.76 MEN1 (0.51) ALDH1A1CES2BCHECES1MCL1
SCHEMBL29283592 0.75 ALDH1A1 (0.57) ALDH1A1CES2BCHECES1MCL1
SCHEMBL13292101 0.74 ALDH1A1 (0.47) ALDH1A1CES2BCHECES1MCL1
SCHEMBL3804212 0.72 ALDH1A1 (0.44) ALDH1A1CES2BCHECES1MCL1
SCHEMBL3804209 0.72 ALDH1A1 (0.44) ALDH1A1CES2BCHECES1MCL1

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-7301040-B2 Bidentate catalyst for olefin polymerization, methods of forming such and products therefrom FINA TECHNOLOGY, INC. (US) 2007-11-27 US disclosed
US-7301040-B2 Bidentate catalyst for olefin polymerization, methods of forming such and products therefrom FINA TECHNOLOGY, INC. (US) 2007-11-27 US disclosed
US-20070043184-A1 Bidentate catalyst for olefin polymerization, methods of forming such and products therefrom FINA TECHNOLOGY, INC. (US) 2007-02-22 US disclosed
US-20070043184-A1 Bidentate catalyst for olefin polymerization, methods of forming such and products therefrom FINA TECHNOLOGY, INC. (US) 2007-02-22 US disclosed