SCHEMBL9439740

SCHEMBL9439740

CCN(CC)c1ccc(C(=CC=CC(c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
TSHR P16473 2/20 0.42
CNR2 P34972 9/20 0.40
ALDH3A1 P30838 1/20 0.39
ALDH1A3 P47895 1/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 3/20 0.37
POLB P06746 3/20 0.37
MAPT P10636 3/20 0.37
KMT2A Q03164 3/20 0.37
MCL1 Q07820 1/20 0.37
NOX1 Q9Y5S8 1/20 0.37
MAPK1 P28482 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
RECQL P46063 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
PSMD14 O00487 1/20 0.37
CYP3A4 P08684 1/20 0.37
GFER P55789 1/20 0.37

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
Iodide SCHEMBL8982997 0.98 ALDH1A1 (0.41) ALDH1A1TSHRCNR2ALDH3A1ALDH1A3
SCHEMBL13813713 0.94 ALDH1A1 (0.38) ALDH1A1TSHRCNR2ALDH3A1ALDH1A3
Perchlorate SCHEMBL9437266 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCNR2ALDH3A1ALDH1A3
Perchlorate SCHEMBL8853460 0.93 ALDH1A1 (0.38) ALDH1A1TSHRCNR2ALDH3A1ALDH1A3
SCHEMBL13813714 0.93 CNR2 (0.47) ALDH1A1TSHRCNR2GAAKDM4E
Bromide SCHEMBL8982786 0.92 CNR2 (0.46) ALDH1A1TSHRCNR2GAAKDM4E
SCHEMBL14507525 0.83 ALDH1A1 (0.40) ALDH1A1TSHRGAAKDM4EMEN1
SCHEMBL9838585 0.82 CHKA (0.32)
SCHEMBL9838582 0.82 CHKA (0.32)
SCHEMBL14283581 0.80 ALDH1A1 (0.52) ALDH1A1TSHRCNR2ALDH3A1ALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0287394-B1 Process for producing optical recording medium CANON KK (JP) 1994-03-02 EP claimed