SCHEMBL9013844

SCHEMBL9013844

CCN(CC)c1cccc(OCOc2cccc(N(CC)CC)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
CYP3A4 P08684 2/20 0.53
KDM4E B2RXH2 3/20 0.50
KMT2A Q03164 2/20 0.50
THRB P10828 2/20 0.50
MEN1 O00255 1/20 0.50
HSD17B10 Q99714 2/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
RECQL P46063 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
MAPT P10636 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
APP P05067 1/20 0.41
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
TERT O14746 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL31339101 0.89 ALDH1A1 (0.55) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL7449633 0.89 ALDH1A1 (0.53) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL1760671 0.89 ALDH1A1 (0.55) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL9116618 0.87 ALDH1A1 (0.52) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL7451458 0.87 ALDH1A1 (0.52) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL9655184 0.85 ALDH1A1 (0.44) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL2089516 0.85 ALDH1A1 (0.50) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL9810819 0.85 ALDH1A1 (0.50) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL27497572 0.84 ALDH1A1 (0.51) ALDH1A1CYP3A4KDM4EKMT2ATHRB
SCHEMBL11243339 0.84 TSHR (0.50) ALDH1A1CYP3A4KDM4EKMT2ATHRB

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-0511664-B1 Electrophotographic photoreceptor MITSUBISHI CHEM CORP (JP) 1996-11-06 EP disclosed
US-5284728-A Electrophotographic photoreceptor containing hydrazone compounds MITSUBISHI KASEI CORPORATION (JP) 1994-02-08 US disclosed
EP-0511664-A1 Electrophotographic photoreceptor Mitsubishi Chemical Corporation (JP) 1992-11-04 EP disclosed