SCHEMBL14289403

SCHEMBL14289403

COONC1=NN(c2ccccc2)C(=O)/C1=C\C=C\c1ccc2c(c1)CCCN2c1ccc2ccsc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.35
MAPK1 P28482 5/20 0.35
KMT2A Q03164 5/20 0.35
ALDH1A1 P00352 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
HTT P42858 3/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.34
OPRK1 P41145 1/20 0.34
MDM2 Q00987 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TUBB4A P04350 1/20 0.30

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
SCHEMBL12428360 0.86 KMT2A (0.38) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL14289205 0.84 KMT2A (0.37) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL14289393 0.81 MAPT (0.38) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL14289241 0.78 KMT2A (0.41) MAPTKMT2AALDH1A1TDP1L3MBTL1
SCHEMBL14289172 0.77 KMT2A (0.38) MAPTKMT2AALDH1A1TDP1L3MBTL1
SCHEMBL14289245 0.75 KMT2A (0.40) MAPTKMT2AALDH1A1TDP1L3MBTL1
SCHEMBL14289207 0.74 MAPT (0.35) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL12428197 0.74 KMT2A (0.48) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL12428234 0.73 MAPT (0.42) MAPTMAPK1KMT2AALDH1A1TDP1
SCHEMBL12428363 0.72 MAPT (0.37) MAPTMAPK1KMT2AALDH1A1TDP1

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-1885015-A1 DYE-SENSITIZED PHOTOELECTRIC CONVERSION DEVICE Nippon Kayaku Kabushiki Kaisha (JP) 2008-02-06 EP disclosed