SCHEMBL8554286

SCHEMBL8554286

C=C(C)C(=O)NCC/C(=C\c1ccc(Cl)c(Cl)c1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 12/20 0.42
▸ PLAAT3 P53816 1/20 0.42
▸ PLAAT5 Q96KN8 1/20 0.42
▸ PLAAT2 Q9NWW9 1/20 0.42
▸ PLAAT4 Q9UL19 1/20 0.42
▸ DPEP1 P16444 1/20 0.39
▸ BCL2A1 Q16548 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GRIN1 Q05586 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34

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
SCHEMBL8552779 0.90 DPEP1 (0.41) PLAAT3PLAAT5PLAAT2PLAAT4DPEP1
SCHEMBL8551925 0.86 GRIK1 (0.46) PLAAT3PLAAT5PLAAT2PLAAT4HTT
SCHEMBL8552324 0.86 MAPT (0.48) HPGDHTTALDH1A1NPC1RAB9A
SCHEMBL8555352 0.84 NLRP3 (0.46) PLAAT3PLAAT5PLAAT2PLAAT4POLB
SCHEMBL8554973 0.84 RAB9A (0.35) PLAAT3PLAAT5PLAAT2PLAAT4HPGD
SCHEMBL8554588 0.83 TRPA1 (0.38) HPGDALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9408933 0.82 PYGL (0.50) PYGLPLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL8551274 0.82 PLAAT3 (0.41) PLAAT3PLAAT5PLAAT2PLAAT4POLB
SCHEMBL8552707 0.82 ALDH1A1 (0.52) PLAAT3PLAAT5PLAAT2PLAAT4POLB
SCHEMBL8550399 0.81 ALDH1A1 (0.41) PLAAT3PLAAT5PLAAT2PLAAT4POLB

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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