SCHEMBL9999693

SCHEMBL9999693

Cc1ccc2nc(C(F)(F)F)cc(SCCN)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ADRB2 P07550 3/20 0.47
ADRA2A P08913 1/20 0.46
HTR2C P28335 1/20 0.46
AXL P30530 1/20 0.46
HRH1 P35367 1/20 0.46
HTR2B P41595 1/20 0.46
HTR6 P50406 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
ELANE P08246 2/20 0.41
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
NCOA1 Q15788 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HIF1A Q16665 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
GAA P10253 1/20 0.38
NT5E P21589 2/20 0.38

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
SCHEMBL9999685 0.82 MAPT (0.64) MAPTADRB2GAANT5EKMT2A
SCHEMBL12961034 0.76 ADRB2 (0.56) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL8234615 0.75 ADRB2 (0.55) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL12961030 0.75 ADRB2 (0.57) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL1536650 0.73 NT5E (0.66) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL30492152 0.73 NT5E (0.66) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL23716945 0.72 ADRB2 (0.55) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL15491345 0.72 ADRB2 (0.55) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL14608815 0.71 ADRB2 (0.53) MAPTADRB2ADRA2AHTR2CAXL
SCHEMBL9999690 0.71 MAPT (0.44) MAPTNT5EKMT2AKDM4EMEN1

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
WO-2018025872-A1 LIQUID CRYSTAL DISPLAY ELEMENT EQUIPPED WITH LIQUID CRYSTAL PANEL HAVING CURVED SURFACE AND LIQUID CRYSTAL ALIGNING AGENT FOR SAME 日産化学工業株式会社 2018-02-08 WO disclosed
WO-2012014898-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 (JP) 2012-02-02 WO disclosed