SCHEMBL7763544

SCHEMBL7763544

COCCOCCN(CCOCCOC)c1ccc(N)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 4/20 0.47
MAPK1 P28482 3/20 0.47
TSHR P16473 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
PSMD14 O00487 1/20 0.47
RECQL P46063 1/20 0.47
GFER P55789 1/20 0.47
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
CA2 P00918 3/20 0.37
ESRRG P62508 1/20 0.37
PHLPP2 Q6ZVD8 1/20 0.33
PPARG P37231 1/20 0.32
APP P05067 3/20 0.32
SCN9A Q15858 1/20 0.32
CYP2D6 P10635 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 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
SCHEMBL28639880 0.95 TDP1 (0.43) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL9191740 0.92 ALDH1A1 (0.56) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL11649109 0.92 ALDH1A1 (0.56) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL994614 0.89 TDP1 (0.54) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL13958424 0.86 TDP1 (0.48) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL31123215 0.84 TDP1 (0.41) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL16391104 0.82 CYP3A4 (0.52) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL24770500 0.82 APP (0.49) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL6285267 0.82 APP (0.49) TDP1ALDH1A1CYP3A4MAPK1TSHR
SCHEMBL25399798 0.81 USP2 (0.40) ALDH1A1TSHRCA2PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737722-B1 New indoaniline metal complex, process for their production, and transparent recording medium and optical recording medium by use thereof JUJO PAPER CO LTD (JP) 2001-07-04 EP disclosed
US-5919928-A Phenanthridine derivatives and metal complexes thereof used for transparent recording medium or optical recording medium NIPPON PAPER INDUSTRIES, CO., LTD. (JP) 1999-07-06 US disclosed
US-5892042-A OPTICAL RECORDING MEDIA WITH ACRIDINE DYES ON TRANSPARENT SUBSTRATE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1999-04-06 US disclosed
US-5792863-A HAVING LARGE ABSORPTION IN NEAR INFRARED, REDUCED ABSORPTION IN VISIBLE RANGE NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1998-08-11 US disclosed
EP-0737722-A2 New indoaniline metal complex, process for their production, and transparent recording medium and optical recording medium by use thereof NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1996-10-16 EP disclosed