SCHEMBL8895540

SCHEMBL8895540

CC(C)C[C@H](NC(=O)CCC1CCCC1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
BCHE P06276 1/20 0.47
FOLH1 Q04609 4/20 0.45
HPGD P15428 1/20 0.45
MAPT P10636 1/20 0.44
PLA2G2A P14555 2/20 0.41
PLA2G5 P39877 2/20 0.41
GRN P28799 1/20 0.41
SORT1 Q99523 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MME P08473 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL4313021 0.98 BCHE (0.49) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4313026 0.98 BCHE (0.49) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4317981 0.90 BCHE (0.50) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4317976 0.90 BCHE (0.50) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4319970 0.89 BCHE (0.49) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4319961 0.89 BCHE (0.49) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL8895660 0.84 ALDH1A1 (0.53) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL4313039 0.83 ALDH1A1 (0.51) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL4313036 0.83 ALDH1A1 (0.51) ALDH1A1MEN1LMNAKMT2ABCHE
SCHEMBL10660233 0.81 HPGD (0.51) ALDH1A1MEN1KMT2AHPGDGRN

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-0584374-B1 PEPTIDE WHICH INHIBITS PHOSPHOLIPASE C KYOWA HAKKO KOGYO KK (JP) 1997-09-24 EP disclosed