SCHEMBL8070063

SCHEMBL8070063

CCc1cccc(CC2CCNC2=O)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
NISCH Q9Y2I1 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
MGLL Q99685 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ALOX5 P09917 1/20 0.36
PDE4D Q08499 2/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MCOLN3 Q8TDD5 1/20 0.35
NOTUM Q6P988 1/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL27343744 0.81 EED (0.53) DDB1CRBNSLC6A4ALDH1A1GAA
SCHEMBL837901 0.80 DDB1 (0.60) DDB1CRBNALDH1A1POLBKMT2A
SCHEMBL30996579 0.77 TSHR (0.48) CRBNALDH1A1GAAPOLBKMT2A
SCHEMBL4961020 0.77 ALDH1A1 (0.50) DDB1CRBNSMN1; SMN2PDE4DALDH1A1
SCHEMBL28104271 0.75 DAO (0.42) DDB1CRBNNISCHHTTALDH1A1
SCHEMBL28260107 0.74 KMT2A (0.43) DDB1CRBNSMN1; SMN2HTTALDH1A1
SCHEMBL27429818 0.74 GSK3B (0.49) DDB1CRBNPDE4DALDH1A1
SCHEMBL22237415 0.73 SMN1; SMN2 (0.51) SMN1; SMN2SLC6A2SLC6A4HTTALDH1A1
SCHEMBL13675547 0.73 TAAR1 (0.38) DDB1CRBNSMN1; SMN2HTTALDH1A1
SCHEMBL8186635 0.72 ESR1 (0.48) DDB1CRBN

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
US-6066666-A OPTIONALLY N-SUBSTITUTED 3-MONO- AND DI-SUBSTITUTED 2-PYRROLIDINONES AND THIOLACTAM ANALOGS; TREAT SEIZURES, ANXIETY, AND ENHANCING 4-AMINOBUTYRIC ACID (GABA)-INDUCED CHLORIDE CURRENTS AT GABA RECEPTOR/IONOPHORE COMPLEX WASHINGTON UNIVERSITY (US) 2000-05-23 US claimed