SCHEMBL2042809

SCHEMBL2042809

CCCCc1cccc(C#N)c1C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.40
CTSS P25774 4/20 0.40
BCHE P06276 1/20 0.37
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DRD3 P35462 2/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34

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
SCHEMBL10732209 0.96 CTSK (0.39) CTSKCTSSBCHECNR1CNR2
SCHEMBL10730136 0.95 CTSK (0.39) CTSKCTSSBCHECNR1CNR2
SCHEMBL4820095 0.92 CTSK (0.45) CTSKCTSSALDH1A1NPSR1DRD3
SCHEMBL16593924 0.85 BCHE (0.43) BCHECNR1CNR2
SCHEMBL27810248 0.85 CTSK (0.36) CTSKCTSSBCHECNR1CNR2
SCHEMBL3480988 0.80 BCHE (0.40) BCHECNR1CNR2
SCHEMBL28168404 0.78 BCHE (0.39) BCHECNR1CNR2DRD3DRD2
SCHEMBL6951071 0.78 BCHE (0.39) BCHECNR1CNR2
SCHEMBL28252845 0.78 KDM4E (0.41) CTSKCTSSALDH1A1DRD3TSHR
SCHEMBL11128220 0.76 TSHR (0.45) CTSKCTSSNPSR1DRD3CYP2D6

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
WO-2013055317-A1 LIQUID CRYSTALS WITH SWITCHABLE WETTABILITY FOR CELL SORTING EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2013-04-18 WO claimed
CN-106164108-B Polymerizable compound, polymer, polymerizable composition, film, and half mirror for projection image display 富士胶片株式会社 2018-04-10 CN disclosed
CN-106164108-A Polymerizable compound, polymer, polymerizable composition, film, and half mirror for projection image display 富士胶片株式会社 2016-11-23 CN disclosed
WO-2013055317-A1 LIQUID CRYSTALS WITH SWITCHABLE WETTABILITY FOR CELL SORTING EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2013-04-18 WO disclosed
WO-2011068365-A2 THE METHOD OF A PDLC TYPE LIGHT CONTROL BODY USED LIGHT WITH LONG WAVELENGTH, THE PDLC TYPE LIGHT CONTROL BODY Q-SYS CO., LTD. (KR) 2011-06-09 WO disclosed