SCHEMBL12880656

SCHEMBL12880656

CCN1N=C(C(=O)O)/C(=C/c2ccc(N(c3ccc(N(CC)CC)cc3)c3ccc(N(CC)CC)cc3)cc2)C1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.48
MEN1 O00255 13/20 0.48
KMT2A Q03164 13/20 0.48
MAPT P10636 9/20 0.48
L3MBTL1 Q9Y468 5/20 0.48
HPGD P15428 5/20 0.48
MAPK1 P28482 4/20 0.48
POLB P06746 2/20 0.48
THRB P10828 2/20 0.48
PKM P14618 2/20 0.48
MDM2 Q00987 2/20 0.48
GAA P10253 2/20 0.48
TNNI3 P19429 2/20 0.48
TNNT2 P45379 2/20 0.48
TNNC1 P63316 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TDP2 O95551 1/20 0.44
NPSR1 Q6W5P4 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
LMNA P02545 3/20 0.43

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
SCHEMBL438157 0.80 MEN1 (0.58) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL12865589 0.78 MEN1 (0.44) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL12880652 0.76 MEN1 (0.58) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL12589925 0.75 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL12894519 0.74 MEN1 (0.41) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL13665934 0.73 MEN1 (0.63) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL14041334 0.71 MEN1 (0.57) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL4746215 0.71 MEN1 (0.57) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL19669960 0.71 MEN1 (0.55) ALDH1A1MEN1KMT2AMAPTL3MBTL1
SCHEMBL13703884 0.70 MEN1 (0.67) ALDH1A1MEN1KMT2AMAPTL3MBTL1

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
US-8338700-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-12-25 US disclosed
US-20110030801-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 US disclosed
EP-1422782-B1 PHOTOELECTRIC CONVERSION ELEMENT SENSITIZED WITH METHINE DYES NIPPON KAYAKU KK (JP) 2011-01-12 EP disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 US disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 US disclosed