SCHEMBL8777562

SCHEMBL8777562

Cc1cc(N(C)C)ccc1C(OC(c1ccc(N(C)C)cc1C)c1ccc(N(C)C)cc1C)c1ccc(N(C)C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.47
MAPT P10636 3/20 0.42
ALDH1A1 P00352 6/20 0.39
TSHR P16473 3/20 0.39
ALOX15 P16050 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TERT O14746 1/20 0.36
APP P05067 1/20 0.36
APAF1 O14727 1/20 0.35
CRHR1 P34998 1/20 0.35
KDM4E B2RXH2 3/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
SLC2A1 P11166 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL8777673 0.89 SLC2A1 (0.40) ESR1MAPTALDH1A1TSHRALOX15
SCHEMBL8777610 0.81 GAA (0.38) ESR1MAPTALDH1A1TSHRALOX15
SCHEMBL962867 0.81 MAPT (0.46) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL3193700 0.81 MAPT (0.46) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL38662618 0.81 MAPT (0.46) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL8777640 0.80 SLC2A1 (0.42) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL8777686 0.79 S100B (0.53) ESR1MAPTALDH1A1TSHRALOX15
SCHEMBL13385286 0.79 ALDH1A1 (0.46) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL8777599 0.78 S100B (0.44) MAPTALDH1A1TSHRALOX15HSD17B10
SCHEMBL3262956 0.78 MAPT (0.43) MAPTALDH1A1TSHRALOX15HSD17B10

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