SCHEMBL21391252

SCHEMBL21391252

Cc1ccc(CC(=O)NCCCNC(=O)Cc2ccc(C)cc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.83
MAPT P10636 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
KMT2A Q03164 6/20 0.60
MEN1 O00255 3/20 0.60
ALDH1A1 P00352 2/20 0.60
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
LMNA P02545 1/20 0.60
EPHX2 P34913 1/20 0.57
POLB P06746 1/20 0.57
GAA P10253 2/20 0.56
ATM Q13315 1/20 0.54

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
SCHEMBL14817909 0.93 HPGD (0.73) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL10170678 0.91 HPGD (1.00) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL14679436 0.90 HPGD (0.73) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL10654981 0.88 ATM (0.73) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL14679397 0.88 HPGD (0.71) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL8237044 0.87 HPGD (0.81) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL14679420 0.87 HPGD (0.69) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL9177806 0.87 HPGD (0.69) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL14679452 0.85 HPGD (0.68) HPGDMAPTL3MBTL1KMT2AMEN1
SCHEMBL14679435 0.85 HPGD (0.68) HPGDMAPTL3MBTL1KMT2AMEN1

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
WO-2019181878-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2019-09-26 WO disclosed