SCHEMBL11048197

SCHEMBL11048197

CCOC(=O)C(NC(C)=O)(C(=O)OCC)C1CC(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.41
KDM4E B2RXH2 2/20 0.41
THRB P10828 3/20 0.40
HTT P42858 2/20 0.39
ALDH1A1 P00352 3/20 0.37
RECQL P46063 1/20 0.37
MAPT P10636 6/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ATM Q13315 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HIF1A Q16665 1/20 0.33
TAAR1 Q96RJ0 2/20 0.32
APP P05067 1/20 0.32
LMNA P02545 1/20 0.32
ADORA2B P29275 1/20 0.32
TSHR P16473 1/20 0.32
POLB P06746 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL11049348 0.68 PKM (0.34) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL16049982 0.66 ALDH1A1 (0.39) KDM4EHTTALDH1A1MAPTMEN1
SCHEMBL13954369 0.65 ALDH1A1 (0.36) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL1322979 0.65 RAB9A (0.49) KDM4EHTTALDH1A1MAPTMEN1
SCHEMBL5722372 0.65 PKM (0.39) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL5722381 0.65 PKM (0.39) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL5722362 0.65 PKM (0.39) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL14457174 0.64 TAAR1 (0.48) PKMKDM4ETHRBHTTALDH1A1
SCHEMBL16682230 0.62 CRBN (0.41) PKMALDH1A1MAPTL3MBTL1LMNA
SCHEMBL18515841 0.62 MAP3K14 (0.39) PKMALDH1A1MAPTL3MBTL1LMNA

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-4465844-A PEPTIDE, GERMICIDE, DISINFECTANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-08-14 US disclosed
US-4436918-A FROM A 2,5-DIOXOPYRROLIDINE COMPOUND TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-03-13 US disclosed