SCHEMBL9501394

SCHEMBL9501394

CCNc1cc(C(=O)OC2CCC3CCCCC3C2)c(N)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 3/20 0.35
ATM Q13315 1/20 0.35
PKM P14618 2/20 0.35
GRK6 P43250 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
MCL1 Q07820 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
P2RY2 P41231 3/20 0.34
HPGD P15428 2/20 0.34
NTRK1 P04629 1/20 0.34
NTRK2 Q16620 1/20 0.34
P2RY4 P51582 4/20 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
SCHEMBL9501396 1.00 MAPT (0.36) MAPTALDH1A1LMNAMAPK1ATM
SCHEMBL9504393 0.93 MAPT (0.35) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL9504389 0.93 MAPT (0.35) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL9505348 0.92 MAPT (0.34) MAPTALDH1A1MAPK1PKMGRK6
SCHEMBL9505343 0.92 MAPT (0.34) MAPTALDH1A1MAPK1PKMGRK6
SCHEMBL9501305 0.90 GNG2 (0.37) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL9501297 0.90 GNG2 (0.37) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL9504395 0.89 P2RY4 (0.46) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL9504399 0.89 P2RY4 (0.46) MAPTALDH1A1LMNAMAPK1PKM
SCHEMBL10579937 0.89 MAPT (0.34) MAPTALDH1A1LMNAMAPK1ATM

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-0307866-B1 DICHROIC COLORING AGENTS FOR LIQUID CRYSTAL DISPLAYS MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-05-12 EP disclosed
US-4883611-A ANTHRAQUINONE COMPOUND CONTAINING DECAHYDRONAPHTHYL GROUP MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1989-11-28 US disclosed
EP-0307866-A2 Dichroic coloring agents for liquid crystal displays MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-03-22 EP disclosed