SCHEMBL12428295

SCHEMBL12428295

CCCCCCCCN1CCc2cc(/C=C/C=C3\C(=O)N(c4ccccc4)N=C3C(=O)O)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 2/20 0.41
APOBEC3G Q9HC16 2/20 0.41
MAPT P10636 11/20 0.41
KMT2A Q03164 11/20 0.41
MEN1 O00255 9/20 0.41
ALDH1A1 P00352 8/20 0.41
MAPK1 P28482 6/20 0.41
HTT P42858 3/20 0.41
MDM2 Q00987 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
L3MBTL1 Q9Y468 6/20 0.41
TDP1 Q9NUW8 5/20 0.41
LMNA P02545 4/20 0.41
POLB P06746 4/20 0.41
ACHE P22303 2/20 0.39
PKM P14618 1/20 0.39
OPRK1 P41145 1/20 0.39
KDM4E B2RXH2 4/20 0.38
HPGD P15428 4/20 0.38

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
SCHEMBL12428485 0.95 KMT2A (0.42) APOBEC3AAPOBEC3GMAPTKMT2AMEN1
SCHEMBL12428330 0.94 KMT2A (0.39) APOBEC3AAPOBEC3GMAPTKMT2AMEN1
SCHEMBL12428321 0.87 KMT2A (0.43) APOBEC3AAPOBEC3GMAPTKMT2AMEN1
SCHEMBL12428311 0.87 APOBEC3A (0.52) APOBEC3AAPOBEC3GMAPTKMT2AMEN1
SCHEMBL12428318 0.86 MAPT (0.42) APOBEC3AAPOBEC3GMAPTKMT2AMEN1
SCHEMBL12510314 0.86 KMT2A (0.46) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL13866486 0.85 ADRB2 (0.44) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL12428196 0.83 ADRB2 (0.40) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL12428339 0.83 ADRB2 (0.40) MAPTKMT2AMEN1ALDH1A1MAPK1
SCHEMBL12428287 0.82 KMT2A (0.40) MAPTKMT2AMEN1ALDH1A1MAPK1

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
US-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed