SCHEMBL24724855

SCHEMBL24724855

N=C(N)NCCCCC(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 1/20 0.53
ROCK2 O75116 4/20 0.49
PRKACA P17612 3/20 0.49
AKT3 Q9Y243 2/20 0.49
NPY4R P50391 5/20 0.48
NPY5R Q15761 5/20 0.48
NPY1R P25929 4/20 0.48
NPY2R P49146 2/20 0.48
NMT1 P30419 5/20 0.47
NMT2 O60551 4/20 0.47
SLC6A5 Q9Y345 1/20 0.44

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
SCHEMBL15185938 0.94 NPY4R (0.51) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL16359252 0.91 NPY4R (0.52) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL19696599 0.90 TLR2 (0.55) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL12749418 0.86 TLR2 (0.68) TLR2ROCK2PRKACAAKT3NMT1
SCHEMBL12971402 0.86 SLC6A5 (0.53) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL12971400 0.86 SLC6A5 (0.53) NPY4RNPY5RNPY1RNPY2RNMT1
SCHEMBL7754998 0.86 TLR2 (0.68) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL22850479 0.86 NPY4R (0.43) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL14583963 0.86 TLR2 (0.67) TLR2ROCK2PRKACAAKT3NPY4R
SCHEMBL13363677 0.85 SLC6A5 (0.56) TLR2ROCK2PRKACAAKT3NMT1

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
WO-2023028338-A2 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2023-03-02 WO disclosed
WO-2023009554-A1 METHODS TO REDUCE ADVERSE EFFECTS OF GENE OR BIOLOGICS THERAPY AVILAR THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed
WO-2022235699-A2 POTENT ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF IMMUNOGLOBULINS AND OTHER PROTEINS AVILAR THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed