SCHEMBL16656169

SCHEMBL16656169

CN=C1c2ccccc2-c2c(C#N)cccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
PDK2 Q15119 1/20 0.43
TSHR P16473 2/20 0.39
ESR2 Q92731 1/20 0.37
LMNA P02545 1/20 0.35
DRD2 P14416 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
USP8 P40818 1/20 0.33
USP7 Q93009 1/20 0.33
HTT P42858 1/20 0.33
MAPK10 P53779 1/20 0.33
PTK2B Q14289 1/20 0.33
NCOA1 Q15788 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NCOA3 Q9Y6Q9 1/20 0.33
NISCH Q9Y2I1 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
SCHEMBL5576916 0.78 MEN1 (0.50) MEN1KMT2APDK2TSHRESR2
SCHEMBL2567528 0.78 MEN1 (0.50) MEN1KMT2APDK2TSHRESR2
SCHEMBL12111786 0.77 MEN1 (0.48) MEN1KMT2APDK2TSHRSMN1; SMN2
SCHEMBL27909137 0.72 ESR2 (0.52) MEN1KMT2APDK2TSHRESR2
SCHEMBL9266802 0.72 USP8 (0.58) MEN1KMT2APDK2TSHRLMNA
SCHEMBL16601743 0.71 MEN1 (0.49) MEN1KMT2APDK2TSHRESR2
SCHEMBL10292917 0.71 KMT2A (0.52) MEN1KMT2ATSHRLMNASMN1; SMN2
SCHEMBL15536685 0.69 TSHR (0.61) MEN1KMT2APDK2TSHRESR2
SCHEMBL18411431 0.69 ESR2 (0.50) MEN1KMT2APDK2TSHRESR2
SCHEMBL2354818 0.69 PDK2 (0.59) MEN1KMT2APDK2TSHRESR2

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-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed