SCHEMBL4381247

SCHEMBL4381247

CC(=O)SC[C@H](C(=O)O)N1C(=O)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.49
ACE P12821 7/20 0.38
CPB2 Q96IY4 1/20 0.35
MME P08473 3/20 0.35
SLC1A2 P43004 1/20 0.34
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL8583037 1.00 ALDH1A1 (0.49) ALDH1A1PKMACECPB2MME
SCHEMBL19664675 0.83 ALDH1A1 (0.46) ALDH1A1PKMACEMMESLC1A2
SCHEMBL73144 0.82 ALDH1A1 (0.54) ALDH1A1PKMMMESLC1A2KMT2A
SCHEMBL2128258 0.79 ALDH1A1 (0.49) ALDH1A1PKMMMESLC1A2KMT2A
SCHEMBL1269476 0.77 ALDH1A1 (0.53) ALDH1A1PKMMMESLC1A2KMT2A
SCHEMBL698898 0.76 ALDH1A1 (0.56) ALDH1A1PKMMMESLC1A2KMT2A
SCHEMBL18037121 0.75 ALDH1A1 (0.40) ALDH1A1PKMACESLC1A2KMT2A
SCHEMBL3505155 0.74 ALDH1A1 (0.58) ALDH1A1PKMMMESLC1A2KMT2A
SCHEMBL12100863 0.73 ALDH1A1 (0.53) ALDH1A1PKMACEMMESLC1A2
SCHEMBL15623808 0.73 ALDH1A1 (0.53) ALDH1A1PKMMMESLC1A2

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-7629295-B2 Determination of a specific immunoglobulin using multiple antigens ROCHE DIAGNOSTICS GMBH (DE) 2009-12-08 US disclosed
US-20050074750-A1 Determination of a specific immunoglobulin using multiple antigens WIENHUES URSULA-HENRIKE (DE) 2005-04-07 US disclosed
US-6613530-B1 Epitopes; antibodies; amino acid sequences; haptens; genetic engineering; chelate compounds; biotin; carriers; use in detection of HIV or Hepatitis C-virus antibodies in liquid sample incubated in presence of solid phase and two antigens ROCHE DIAGNOSTICS GMBH (DE) 2003-09-02 US disclosed