SCHEMBL8652701

SCHEMBL8652701

O=C(CC(=O)N[C@@H]1[C@@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O)N[C@@H]1[C@@H](OCc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 1/20 0.48
▸ LGALS8 O00214 1/20 0.47
▸ SYNJ2 O15056 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ ALPL P05186 1/20 0.47
▸ ALPI P09923 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ ALPG P10696 1/20 0.47
▸ PABPC1 P11940 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ GALK1 P51570 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ CASP6 P55212 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ RIN1 Q13671 1/20 0.47
▸ EIF4H Q15056 1/20 0.47
▸ CA1 P00915 2/20 0.47

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
SCHEMBL15514659 0.91 SLC6A2 (0.49) SLC6A2LGALS8SYNJ2POLBKDM4E
SCHEMBL21058378 0.90 CA1 (0.48) SLC6A2LGALS8POLBCA1CA2
SCHEMBL13031052 0.89 MAPK1 (0.58) POLB
SCHEMBL7150940 0.89 MAPK1 (0.58) POLB
SCHEMBL5841792 0.89 MAPK1 (0.58) POLB
SCHEMBL542627 0.89 MAPK1 (0.58) POLB
SCHEMBL20643560 0.89 MAPK1 (0.58) POLB
SCHEMBL21097246 0.89 MAPK1 (0.58) POLB
SCHEMBL14544300 0.89 MAPK1 (0.58) POLB
SCHEMBL14520980 0.89 MAPK1 (0.58) POLB

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
US-5767268-A TREATMENT OF DISORDERS CHARACTERIZED BY EXCESSIVE OR DESTRUCTIVE PROLIFERATION OF SMOOTH MUSCLE CELLS HOFFMANN-LA ROCHE INC. (US) 1998-06-16 — — US disclosed
EP-0741139-A1 Sulphuric acid esters of amino sugars F. HOFFMANN-LA ROCHE AG (CH) 1996-11-06 — — EP disclosed
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