SCHEMBL11243322

SCHEMBL11243322

O=C(CN1CCCC1=O)Nc1cccc(NC(=O)CN2CCCC2=O)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.68
LMNA P02545 1/20 0.53
MAP4K4 O95819 1/20 0.49
ATAD2 Q6PL18 1/20 0.49
CECR2 Q9BXF3 1/20 0.49
TSHR P16473 2/20 0.47
GSK3B P49841 1/20 0.46
MAPK14 Q16539 1/20 0.46
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
GRK2 P25098 1/20 0.45
MAPK1 P28482 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NQO2 P16083 1/20 0.45
PORCN Q9H237 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
PARP1 P09874 1/20 0.43
GLS O94925 1/20 0.42

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
SCHEMBL11391291 0.81 HTT (1.00) HTTLMNAATAD2CECR2TSHR
Nefiracetam SCHEMBL135856 0.79 HTT (0.66) HTTLMNAMAP4K4ATAD2CECR2
SCHEMBL11240697 0.78 HTT (0.57) HTTLMNAMAP4K4ATAD2CECR2
SCHEMBL6775638 0.77 HTT (0.71) HTTMAP4K4ATAD2CECR2TSHR
SCHEMBL17896872 0.77 HTT (0.71) HTTLMNAMAP4K4ATAD2CECR2
SCHEMBL4191223 0.76 ALDH1A1 (0.60) HTTALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL1355628 0.75 HTT (0.74) HTTLMNAMAP4K4ATAD2CECR2
SCHEMBL7437681 0.75 HTT (0.60) HTTLMNAATAD2CECR2ALDH1A1
SCHEMBL5197138 0.75 HTT (0.68) HTTLMNATSHRALDH1A1POLB
Dupracetam SCHEMBL1814646 0.74 TSHR (0.63) HTTLMNAATAD2CECR2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4324787-A 2-Oxo-1-pyrrolidineacetic acid compounds and their medicinal use TROPONWERKE GMBH & CO., KG (DE) 1982-04-13 US disclosed
EP-0003029-B1 NEW 2-OXO-1-PYRROLIDINE ACETIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION Troponwerke GmbH & Co. KG (DE) 1980-12-10 EP disclosed
EP-0003029-A2 New 2-oxo-1-pyrrolidine acetic acid derivatives, process for their preparation, medicaments containing them and process for their preparation Troponwerke GmbH & Co. KG (DE) 1979-07-25 EP disclosed