SCHEMBL8777724

SCHEMBL8777724

CCCc1ccc(COC(c2ccc(N(C)C)cc2)c2ccc(N(CC)CC)cc2OCC)cc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.34
TDP1 Q9NUW8 3/20 0.34
APP P05067 5/20 0.33
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
MAPK1 P28482 2/20 0.31
ALDH1A1 P00352 3/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
RXRA P19793 1/20 0.31
HNF4A P41235 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
GAA P10253 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
SCHEMBL8777736 0.90 APP (0.41) CALM1TDP1APPMEN1KMT2A
SCHEMBL8777700 0.90 MEN1 (0.35) TDP1APPMEN1KMT2AMAPK1
SCHEMBL8777625 0.89 CCR5 (0.38) TDP1MEN1KMT2ACYP3A4TSHR
SCHEMBL8777741 0.89 SLC2A1 (0.42) CALM1TDP1APPMEN1KMT2A
SCHEMBL8777670 0.89 MAPK1 (0.38) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777653 0.84 RXRA (0.38) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777563 0.83 NOX1 (0.40) MEN1KMT2ATSHRRXRAHNF4A
SCHEMBL8777629 0.81 ALDH1A1 (0.37) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777642 0.81 TDP1 (0.41) TDP1MEN1KMT2AMAPK1ALDH1A1
SCHEMBL8777780 0.81 RXRA (0.41) MEN1KMT2AMAPK1ALDH1A1RXRA

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