SCHEMBL8549459

SCHEMBL8549459

C=CC(=O)NCCC/C(=C\c1ccc(Cl)c(Cl)c1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 15/20 0.52
▸ DPEP1 P16444 1/20 0.39
▸ TGM2 P21980 1/20 0.38
▸ CCR2 P41597 1/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ DRD3 P35462 1/20 0.36

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
SCHEMBL9408933 0.93 PYGL (0.50) PYGLDPEP1
SCHEMBL8549538 0.86 GRIK1 (0.46) PYGLTGM2
SCHEMBL8549387 0.82 DPEP1 (0.42) PYGLDPEP1
SCHEMBL8551267 0.79 ZDHHC20 (0.42) TGM2
SCHEMBL8546512 0.78 VCAM1 (0.44) —
SCHEMBL8547344 0.78 TGM2 (0.38) PYGLTGM2
SCHEMBL8547085 0.77 PDCD1 (0.43) TGM2
SCHEMBL8552907 0.77 ALDH1A1 (0.47) TGM2
SCHEMBL8554286 0.76 PYGL (0.42) PYGLDPEP1
SCHEMBL8551077 0.76 RAB9A (0.37) PYGLTGM2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0611786-B1 Orientation layer for liquid crystals ROLIC AG (CH) 1999-04-14 — — EP disclosed
EP-0611786-A1 Orientation layer for liquid crystals F. HOFFMANN-LA ROCHE AG (CH) 1994-08-24 — — EP disclosed
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