SCHEMBL11242670

SCHEMBL11242670

O=C(CN1CCCC1=O)NCCNC(=O)CN1CCCC1=O

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.59
TSHR P16473 2/20 0.59
KMT2A Q03164 3/20 0.53
NQO2 P16083 1/20 0.49
LMNA P02545 1/20 0.49
ALDH1A1 P00352 1/20 0.48
ADRA1D P25100 4/20 0.46
ADRA1A P35348 4/20 0.46
ADRA1B P35368 4/20 0.46
ATAD2 Q6PL18 1/20 0.45
CECR2 Q9BXF3 1/20 0.45
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PIK3CD O00329 1/20 0.43

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
SCHEMBL5255092 0.92 HTT (0.52) HTTTSHRKMT2ANQO2LMNA
SCHEMBL11245716 0.91 HTT (0.55) HTTTSHRKMT2ANQO2LMNA
SCHEMBL9208885 0.91 HTT (0.55) HTTTSHRKMT2ANQO2LMNA
SCHEMBL8961445 0.90 TSHR (0.57) HTTTSHRKMT2ANQO2LMNA
SCHEMBL8961486 0.89 LMNA (0.51) HTTTSHRKMT2ANQO2LMNA
SCHEMBL9851181 0.89 KMT2A (0.58) TSHRKMT2AALDH1A1MAPK1SMN1; SMN2
SCHEMBL11384074 0.86 HTT (0.50) HTTTSHRKMT2ANQO2LMNA
SCHEMBL11553497 0.86 HTT (0.50) HTTTSHRKMT2ANQO2LMNA
SCHEMBL20618032 0.86 LMNA (0.51) HTTTSHRKMT2ANQO2LMNA
SCHEMBL11559597 0.86 ADRA1D (0.56) HTTTSHRKMT2AALDH1A1ADRA1D

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-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