SCHEMBL9233052

SCHEMBL9233052

CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NCCCCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 2/20 0.49
▸ SLC5A2 P31639 4/20 0.47
▸ SLC5A1 P13866 2/20 0.47
▸ LGALS8 O00214 2/20 0.46
▸ FUCA1 P04066 2/20 0.44
▸ CA2 P00918 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ CA1 P00915 1/20 0.43
▸ SYNJ2 O15056 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ ALPL P05186 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ ALPI P09923 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ALPG P10696 1/20 0.43
▸ PABPC1 P11940 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ GALK1 P51570 1/20 0.43

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
SCHEMBL9233060 1.00 OGA (0.49) OGASLC5A2SLC5A1LGALS8FUCA1
SCHEMBL9231731 0.83 CA2 (0.51) OGASLC5A2SLC5A1LGALS8CA2
SCHEMBL9231724 0.83 CA2 (0.51) OGASLC5A2SLC5A1LGALS8CA2
SCHEMBL9231776 0.79 GBA1 (0.54) LGALS8CA2CA9CA1
SCHEMBL9231772 0.79 GBA1 (0.54) LGALS8CA2CA9CA1
SCHEMBL11015903 0.79 MAPK1 (0.48) LGALS8
SCHEMBL9231603 0.77 VEGFA (0.40) CA2CA1POLB
SCHEMBL9231600 0.77 VEGFA (0.40) CA2CA1POLB
SCHEMBL30103356 0.76 OGA (0.51) OGALGALS8CA2CA9CA1
SCHEMBL9225200 0.76 SLC5A1 (0.44) SLC5A2SLC5A1FUCA1CA2CA9

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
EP-0653434-A1 Glucosamine derivative, process for preparing the same and synthetic intermediate thereof TANABE SEIYAKU CO., LTD. (JP) 1995-05-17 — — EP disclosed
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