SCHEMBL8777832

SCHEMBL8777832

CCOc1cc(N(CC)CC)ccc1C(COCC(c1ccc(N(C)C)cc1)c1ccc(N(CC)CC)cc1OCC)c1ccc(N(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
RXRA P19793 3/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
GAA P10253 2/20 0.35
SLC2A1 P11166 1/20 0.34
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
GFER P55789 2/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 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
SCHEMBL8777819 0.93 ALDH1A1 (0.38) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777695 0.90 TDP1 (0.45) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777692 0.88 MEN1 (0.35) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777590 0.88 ALDH1A1 (0.41) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777720 0.88 RXRA (0.42) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777564 0.87 SLC16A3 (0.36) TDP1MEN1KMT2AMAPK1RXRA
SCHEMBL8777544 0.85 CNR2 (0.36) ALDH1A1L3MBTL1RXRARXRBRXRG
SCHEMBL9352078 0.85 TDP1 (0.38) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777606 0.84 S100B (0.42) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777629 0.82 ALDH1A1 (0.37) TDP1MEN1KMT2AMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0587184-B1 Pressure sensitive recording materials NEW OJI PAPER CO LTD (JP) 1997-12-29 EP disclosed
US-5478793-A Basic dye-containing layer and color accetpor-containing layer formed on same or different surfaces; basic dye enclosed in synthetic polymer microcapsules, color acceptor is activated clay containing silica KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1995-12-26 US disclosed
EP-0587184-A2 Pressure sensitive recording materials NEW OJI PAPER CO., LTD. (JP) 1994-03-16 EP disclosed