SCHEMBL27363028

SCHEMBL27363028

CCCCCCCCCCCCCCCC(=O)CCCCCC[C@H](N)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.59
GRIK2 Q13002 2/20 0.59
NOD1 Q9Y239 5/20 0.57
MAPT P10636 2/20 0.57
KMT2A Q03164 1/20 0.57
SLC1A2 P43004 2/20 0.56
SLC1A1 P43005 2/20 0.56
DDAH1 O94760 2/20 0.53
GSR P00390 1/20 0.52
GPR84 Q9NQS5 3/20 0.50
FFAR1 O14842 2/20 0.50
NOS1 P29475 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50
NOS2 P35228 1/20 0.49
SLC1A3 P43003 1/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL28007614 1.00 GRIK1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL28007955 1.00 GRIK1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL28007603 1.00 GRIK1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL28921485 1.00 GRIK1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL28818201 1.00 GRIK1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL27403984 0.96 NOD1 (0.57) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL17537076 0.93 NOD1 (0.59) GRIK1GRIK2NOD1MAPTKMT2A
SCHEMBL23531056 0.90 GRIK1 (0.69) GRIK1GRIK2NOD1MAPTSLC1A2
SCHEMBL1960725 0.90 GRIK1 (0.69) GRIK1GRIK2NOD1MAPTSLC1A2
SCHEMBL3696618 0.90 GRIK1 (0.69) GRIK1GRIK2NOD1MAPTSLC1A2

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
WO-2024040245-A1 PEPTIDE DERIVATIVES AND RELATED USES AS OREXIN AGONISTS CENTESSA PHARMACEUTICALS (OREXIA) LIMITED (GB) 2024-02-22 WO disclosed