SCHEMBL9305582

SCHEMBL9305582

CCN(CC)CC(=O)c1c(C)cc(C)cc1C.[Cu]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.54
LMNA P02545 4/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 6/20 0.43
MAPT P10636 6/20 0.41
KDM4E B2RXH2 2/20 0.41
AGTR1 P30556 1/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 1/20 0.40
MC4R P32245 1/20 0.40
SCN4A P35499 1/20 0.40
MC3R P41968 1/20 0.40
HTR3A P46098 1/20 0.40
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
SCN3A Q9NY46 1/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 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
SCHEMBL17118290 0.79 ALDH1A1 (0.57) HPGDLMNAKMT2AALDH1A1MAPT
SCHEMBL11210247 0.76 MEN1 (0.50) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL1770114 0.74 GSK3B (0.48) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL11053483 0.73 MEN1 (0.51) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL7865769 0.72 ALDH1A1 (0.45) HPGDLMNAMEN1KMT2ASMN1; SMN2
Trimecaine SCHEMBL24692 0.71 HPGD (0.97) HPGDLMNAMEN1KMT2AALDH1A1
SCHEMBL8412767 0.71 ALDH1A1 (0.47) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL8412772 0.71 ALDH1A1 (0.47) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL9598950 0.71 ALDH1A1 (0.44) HPGDLMNAMEN1KMT2ASMN1; SMN2
SCHEMBL1003369 0.71 HPGD (0.69) HPGDLMNAMEN1KMT2ASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5368768-A Copper and barium (dialkylaminoalcoholate) solutions AKZO NOBEL INC. (US) 1994-11-29 US disclosed
US-5252247-A Metal (dialkylaminoalcoholate) solutions AKZO AMERICA INC. (US) 1993-10-12 US disclosed