SCHEMBL7464458

SCHEMBL7464458

C=C(C(=O)O)C(CCN)CC(C)O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.41
GABBR2 O75899 2/20 0.35
GABBR1 Q9UBS5 2/20 0.35
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
ALPL P05186 1/20 0.30

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
SCHEMBL6839141 0.84 TET2 (0.33) SLC1A3SLC1A2ALPL
SCHEMBL8605952 0.75 CHRM1 (0.36) SLC1A3SLC1A2SLC1A1
SCHEMBL5685766 0.74 TSHR (0.32)
SCHEMBL2122491 0.74 GRIK1 (0.42) ALPL
SCHEMBL338828 0.71 TET2 (0.38)
SCHEMBL9410931 0.70 TP53 (0.38) SLC1A3SLC1A2SLC1A1
SCHEMBL1746342 0.69 SLC1A3 (0.45) SLC1A3SLC1A2
SCHEMBL16697955 0.68 CPB2 (0.46)
SCHEMBL10950283 0.68 CHRM1 (0.45) SLC1A3SLC1A2SLC1A1
SCHEMBL5501731 0.67 SLC1A3 (0.43) GABRR1SLC1A3SLC1A2SLC1A1

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
EP-1197504-A1 THERMOPLASTIC POLYMER HAVING POLAR GROUP, USE THEREOF, AND UNSATURATED COMPOUNDS HAVING POLAR GROUP Mitsui Chemicals, Inc. (JP) 2002-04-17 EP disclosed