SCHEMBL16707447

SCHEMBL16707447

Cc1cc(C)c(C)c(SC#N)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.38
USP8 P40818 1/20 0.38
USP5 P45974 1/20 0.38
USP4 Q13107 1/20 0.38
USP7 Q93009 1/20 0.38
ALDH1A1 P00352 6/20 0.37
MAPT P10636 5/20 0.37
HTT P42858 1/20 0.37
HPGD P15428 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GFER P55789 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL16707519 0.80 USP2 (0.39) USP2USP8USP5USP4USP7
SCHEMBL3411697 0.75 AR (0.39) USP2USP8USP5USP4USP7
SCHEMBL7939185 0.74 MEN1 (0.39) USP2USP8USP5USP4USP7
SCHEMBL30673282 0.74 HAO1 (0.43) USP2USP8USP5USP4USP7
SCHEMBL10897641 0.74 HAO1 (0.43) USP2USP8USP5USP4USP7
SCHEMBL22618598 0.74 RAPGEF4 (0.38) ALDH1A1MAPTHPGDLMNARAPGEF4
SCHEMBL16707477 0.74 USP2 (0.44) USP2USP8USP5USP4USP7
SCHEMBL9191936 0.74 RAPGEF4 (0.38) ALDH1A1MAPTHPGDNPC1LMNA
SCHEMBL9488033 0.74 MAPT (0.41) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL16707460 0.72 USP2 (0.36) USP2USP8USP5USP4USP7

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-9647218-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-05-09 US disclosed
US-20150129849-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2015-05-14 US disclosed