SCHEMBL11599237

SCHEMBL11599237

CCC(N)C(=O)N[C@H]([C]=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSC P53634 6/20 0.66
KDM4E B2RXH2 2/20 0.56
MAPT P10636 2/20 0.56
MEN1 O00255 1/20 0.56
LMNA P02545 1/20 0.56
MPO P05164 1/20 0.56
TSHR P16473 1/20 0.56
BLM P54132 1/20 0.56
PMP22 Q01453 1/20 0.56
KMT2A Q03164 1/20 0.56
HIF1A Q16665 1/20 0.56
HTR2A P28223 2/20 0.55
ADRB1 P08588 1/20 0.51
HTR1A P08908 1/20 0.51
ADRA2A P08913 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR1D P28221 1/20 0.51
HTR1B P28222 1/20 0.51
HTR2C P28335 1/20 0.51
HTR1E P28566 1/20 0.51

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
SCHEMBL27871540 0.92 CTSC (0.64) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL9118550 0.89 CTSC (0.61) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL6906379 0.89 CTSC (0.62) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL28081233 0.89 CTSC (0.62) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL2183137 0.88 CTSC (0.61) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL8892785 0.87 CTSC (0.59) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL2195208 0.87 CTSC (0.59) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL2192888 0.86 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL8397051 0.86 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA
SCHEMBL8397046 0.86 KDM4E (0.60) CTSCKDM4EMAPTMEN1LMNA

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-4082736-A NOVEL IMMUNOLOGICAL ADJUVANT COMPOUNDS AND METHODS OF PREPARATION THEREOF SYNTEX (U.S.A.) INC. (US) 1978-04-04 US claimed