SCHEMBL8777700

SCHEMBL8777700

CCOc1cc(N(CC)CC)ccc1C(OCc1ccc(C)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 3/20 0.35
POLB P06746 1/20 0.35
CNR2 P34972 7/20 0.34
CNR1 P21554 4/20 0.34
APP P05067 4/20 0.33
GAA P10253 1/20 0.33
FFAR1 O14842 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.32
IDO1 P14902 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL8777736 0.91 APP (0.41) MEN1KMT2ATDP1POLBAPP
SCHEMBL8777625 0.90 CCR5 (0.38) MEN1KMT2ATDP1POLBCNR2
SCHEMBL8777724 0.90 CALM1 (0.34) MEN1KMT2ATDP1APPGAA
SCHEMBL8777741 0.90 SLC2A1 (0.42) MEN1KMT2ATDP1POLBAPP
SCHEMBL8777670 0.90 MAPK1 (0.38) MEN1KMT2ATDP1POLBCNR2
SCHEMBL8777563 0.84 NOX1 (0.40) MEN1KMT2ACNR2CNR1TSHR
SCHEMBL8777653 0.83 RXRA (0.38) MEN1KMT2ATDP1GAAALDH1A1
SCHEMBL8777629 0.82 ALDH1A1 (0.37) MEN1KMT2ATDP1GAAALDH1A1
SCHEMBL8777642 0.81 TDP1 (0.41) MEN1KMT2ATDP1POLBCNR2
SCHEMBL8777842 0.81 ALDH1A1 (0.39) MEN1KMT2ATDP1GAAALDH1A1

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