SCHEMBL28116797

SCHEMBL28116797

CCC(=O)c1ccccc1-c1cccc(CN)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFD P00746 6/20 0.44
HTR7 P34969 1/20 0.43
AOC3 Q16853 2/20 0.42
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
PLG P00747 2/20 0.41
PLAU P00749 2/20 0.41
F11 P03951 1/20 0.40
KLKB1 P03952 1/20 0.40
F7 P08709 1/20 0.40
TPSB2 P20231 1/20 0.40
PDK2 Q15119 1/20 0.40
BCAT2 O15382 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
USP28 Q96RU2 1/20 0.39

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
SCHEMBL8820693 0.89 HTR7 (0.58) HTR7AOC3MEN1ALDH1A1KMT2A
SCHEMBL28116861 0.88 BCL2 (0.49) HTR7MEN1ALDH1A1KMT2APDK2
SCHEMBL27627678 0.86 LTB4R2 (0.47) MEN1ALDH1A1KMT2APDK2BCAT2
SCHEMBL20946451 0.83 BCAT2 (0.61) CFDHTR7PLGPLAUF11
SCHEMBL19237016 0.83 CFD (0.50) CFDALDH1A1LOXL2PLGPLAU
Hydrochloric Acid SCHEMBL20593581 0.82 CFD (0.49) CFDAOC3ALDH1A1PLGPLAU
SCHEMBL5475393 0.81 LOXL2 (0.57) CFDHTR7MEN1ALDH1A1KMT2A
SCHEMBL27471756 0.81 CSNK2A1 (0.47) MAPTSMN1; SMN2L3MBTL1PLA2G10PLA2G2A
SCHEMBL9696125 0.80 HSP90AB1 (0.49) MEN1KMT2APDK2BCAT2MAPT
SCHEMBL30505632 0.79 BCAT2 (0.57) MEN1ALDH1A1KMT2APDK2BCAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106547168-A A kind of black-matrix material compositionss and application 深圳市华星光电技术有限公司 2017-03-29 CN disclosed