SCHEMBL5898308

SCHEMBL5898308

CCCC[B-](c1ccc(C(F)(F)F)cc1)(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KIF11 P52732 3/20 0.38
TLR8 Q9NR97 1/20 0.36
TAAR1 Q96RJ0 1/20 0.34
NOS1 P29475 3/20 0.34
ALDH1A1 P00352 3/20 0.33
NOS3 P29474 2/20 0.33
NOS2 P35228 2/20 0.33
BLM P54132 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
IDO1 P14902 2/20 0.33
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL309257 0.82 HDAC3 (0.40) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9003413 0.81 GABRA2 (0.36) LMNAMEN1KMT2AHTTSMN1; SMN2
Lithium Ion SCHEMBL9003373 0.79 GABRA2 (0.35) LMNAMEN1KMT2AHTTSMN1; SMN2
SCHEMBL308587 0.78 HTR7 (0.41) LMNATSHRTP53
Lithium Ion SCHEMBL8757202 0.76 HTR7 (0.40) LMNATSHRTP53
SCHEMBL6428385 0.76 HTR7 (0.40) LMNATSHRTP53
SCHEMBL20060637 0.76 HDAC3 (0.43) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL307072 0.75 HTT (0.38) LMNAMEN1KMT2AHTTSMN1; SMN2
Butylamine SCHEMBL4361410 0.75 HDAC3 (0.36) LMNAMEN1KMT2ASMN1; SMN2ALDH1A1
Butylamine SCHEMBL6047452 0.74 MEN1 (0.39) LMNAMEN1KMT2AHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7049350-B2 Polymerizable compound, polymerizable composition and cured product containing the compound SHOWA DENKO K.K. (JP) 2006-05-23 US disclosed
US-20040235980-A1 Polymerizable compound, polymerizable composition and cured product containing the compound SHOWA DENKO K.K. (JP) 2004-11-25 US disclosed