SCHEMBL8551267

SCHEMBL8551267

C=CC(=O)NCCC/C(=C\c1ccc(CC)cc1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ZDHHC20 Q5W0Z9 1/20 0.42
▸ ZDHHC2 Q9UIJ5 1/20 0.42
▸ TGM2 P21980 6/20 0.41
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ AKR1C3 P42330 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ TBXAS1 P24557 2/20 0.37
▸ ALOX5 P09917 2/20 0.37
▸ PTGES O14684 1/20 0.37
▸ PPARG P37231 1/20 0.37

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
SCHEMBL8549538 0.85 GRIK1 (0.46) ZDHHC20ZDHHC2TGM2HDAC3HDAC4
SCHEMBL8555056 0.82 THRB (0.43) ZDHHC20ZDHHC2TGM2GAATBXAS1
SCHEMBL8549680 0.81 TEAD1 (0.40) TGM2HDAC3HDAC4HDAC1HDAC7
SCHEMBL8547481 0.79 TGM2 (0.43) ZDHHC20ZDHHC2TGM2HDAC3HDAC4
SCHEMBL8549459 0.79 PYGL (0.52) TGM2
SCHEMBL8550400 0.78 TGM2 (0.38) ZDHHC20ZDHHC2TGM2HDAC3HDAC4
SCHEMBL8554406 0.77 ACACB (0.43) ALOX5EGFRLMNA
SCHEMBL8551807 0.76 TGM2 (0.43) TGM2GAALMNA
SCHEMBL8548352 0.76 SMN1; SMN2 (0.42) AKR1C3TBXAS1ALOX5PTGESPPARG
SCHEMBL8546509 0.76 TGM2 (0.47) TGM2HDAC3HDAC1HDAC2HDAC8

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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