SCHEMBL7203814

SCHEMBL7203814

CCCCOC(=O)C(N)CC(N)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 5/20 0.53
SLC1A1 P43005 5/20 0.53
SLC1A3 P43003 4/20 0.53
GRIK1 P39086 5/20 0.51
GRIK2 Q13002 4/20 0.51
NOD1 Q9Y239 2/20 0.47
ALDH1A1 P00352 1/20 0.45
SLC7A5 Q01650 1/20 0.45
ATM Q13315 1/20 0.42
P2RY10 O00398 4/20 0.42
GPR34 Q9UPC5 2/20 0.42
HCAR2 Q8TDS4 1/20 0.42
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL5853017 0.95 SLC1A2 (0.54) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL27488051 0.86 SLC1A2 (0.50) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL8931432 0.84 NOD1 (0.63) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL8964483 0.83 ALDH1A1 (0.47) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL14502551 0.83 ALDH1A1 (0.47) SLC1A2SLC1A1SLC1A3GRIK1NOD1
SCHEMBL8435788 0.83 ALDH1A1 (0.47) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL2505997 0.83 ALDH1A1 (0.47) SLC1A2SLC1A1SLC1A3GRIK1GRIK2
SCHEMBL8407945 0.83 ALDH1A1 (0.47) SLC1A2SLC1A1SLC1A3GRIK1NOD1
Hydrochloric Acid SCHEMBL2505994 0.81 ALDH1A1 (0.45) SLC1A2SLC1A1SLC1A3NOD1ALDH1A1
Hydrochloric Acid SCHEMBL5709063 0.81 S1PR1 (0.46) SLC1A2SLC1A1SLC1A3NOD1ALDH1A1

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-6590061-B1 Synthetic polypeptide or peptides having narrow molecular weight distribution used as telechelic polymers for synthesis of block or graft copolymers INSTITUTE OF MACROMOLECULAR CHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) 2003-07-08 US claimed