SCHEMBL16213792

SCHEMBL16213792

CO[C@H]1C(O)C(NC(C)=O)C(OC2C(CO)OC(C)[C@@H](NC(C)=O)[C@H]2O)O[C@H]1CO

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 8/20 0.53
▸ LGALS8 O00214 1/20 0.53
▸ LGALS4 P56470 1/20 0.53
▸ LGALS7; LGALS7B P47929 3/20 0.51
▸ LGALS1 P09382 1/20 0.51
▸ CD69 Q07108 1/20 0.50
▸ LGALS9 O00182 3/20 0.49
▸ CHIA Q9BZP6 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ MAPK1 P28482 1/20 0.45
▸ AMY2A P04746 1/20 0.42

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
SCHEMBL15583488 1.00 LGALS3 (0.53) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL21180426 1.00 LGALS3 (0.53) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL16311989 1.00 LGALS3 (0.53) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL14865928 1.00 LGALS3 (0.53) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL17584825 0.94 LGALS3 (0.54) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL21334208 0.91 CD69 (0.59) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL12454819 0.91 CD69 (0.59) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL21347009 0.91 CD69 (0.59) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL19187558 0.91 CD69 (0.59) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1
SCHEMBL13784257 0.91 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS7; LGALS7BLGALS1

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-9445589-B2 Active compounds combinations comprising a lipo-chitooligosaccharide derivative and a nematicide, insecticidal or fungicidal compound BAYER CROPSCIENCE AG (DE) 2016-09-20 — — US disclosed
US-8877684-B2 Pesticidal composition comprising a synthetic compound useful as nodulation agent of leguminous plants and an insecticide compound BAYER CROPSCIENCE AG (DE) 2014-11-04 — — US disclosed
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