SCHEMBL13155260

SCHEMBL13155260

CCCOCCOCC(COCC(COCC(COCC(COCC(COCC(COCCOCCOOC)OCCOCCOC=O)OCCOCCOC=O)OCCOCCOC=O)OCCOCCOC=O)OCCOCCOC=O)OCCOCCOC=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 2/20 0.32
▸ LPAR3 Q9UBY5 2/20 0.32

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
SCHEMBL13155378 0.91 LPAR1 (0.36) LPAR1LPAR3
SCHEMBL13155348 0.88 HSD17B10 (0.36) LPAR1LPAR3
SCHEMBL12341860 0.88 HSD17B10 (0.36) LPAR1LPAR3
SCHEMBL16473876 0.78 HSD17B10 (0.44) LPAR1LPAR3
SCHEMBL14329141 0.77 — —
SCHEMBL23408864 0.76 HSD17B10 (0.46) LPAR1LPAR3
SCHEMBL12317240 0.74 LPAR1 (0.34) LPAR1LPAR3
SCHEMBL5401232 0.74 CYP3A4 (0.33) —
SCHEMBL4397692 0.74 — —
SCHEMBL4396233 0.74 CYP3A4 (0.33) —

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
US-7794700-B2 Multimeric VLA-4 antagonists comprising polymer moieties ELAN PHARMACEUTICALS INC. (US) 2010-09-14 — — US disclosed
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