SCHEMBL6816403

SCHEMBL6816403

NCCCCCCO[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]1S

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 3/20 0.47
LGALS3 P17931 3/20 0.47
LGALS4 P56470 3/20 0.47
SLC2A1 P11166 1/20 0.45
IGF2R P11717 2/20 0.38
GJB2 P29033 1/20 0.37
MAPK1 P28482 1/20 0.37
GBA1 P04062 2/20 0.37
IFNG P01579 1/20 0.34
FGF1 P05230 1/20 0.34
FGF2 P09038 1/20 0.34
BMP2 P12643 1/20 0.34
VEGFA P15692 1/20 0.34
SFRP1 Q8N474 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
SCHEMBL6221340 1.00 LGALS8 (0.47) LGALS8LGALS3LGALS4SLC2A1IGF2R
SCHEMBL9350378 0.85 GBA1 (0.56) LGALS8LGALS3LGALS4SLC2A1GJB2
SCHEMBL3958896 0.85 GBA1 (0.56) LGALS8LGALS3LGALS4SLC2A1GJB2
SCHEMBL9724527 0.85 GBA1 (0.56) LGALS8LGALS3LGALS4SLC2A1GJB2
SCHEMBL21878964 0.85 SLC2A1 (0.54) LGALS8LGALS3LGALS4SLC2A1IGF2R
SCHEMBL11439847 0.85 SLC2A1 (0.54) LGALS8LGALS3LGALS4SLC2A1IGF2R
SCHEMBL7904800 0.85 SLC2A1 (0.54) LGALS8LGALS3LGALS4SLC2A1IGF2R
SCHEMBL4805569 0.83 SLC2A1 (0.51) LGALS8LGALS3LGALS4SLC2A1IGF2R
SCHEMBL17734348 0.78 LGALS8 (0.58) LGALS8LGALS3LGALS4IGF2RMAPK1
SCHEMBL7529325 0.78 LGALS3 (0.39) LGALS8LGALS3LGALS4SLC2A1MAPK1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6124352-A DINITROBENZOIC ACID COMPOUNDS AND DERIVATIVES THEREOF JEMLAN, LLC (US) 2000-09-26 US claimed
EP-0475160-B2 Preparation for drug application in minute droplet form IDEA AG (DE) 2004-07-14 EP disclosed
US-6165500-A Preparation for the application of agents in mini-droplets IDEA AG (DE) 2000-12-26 US disclosed
US-6124352-A DINITROBENZOIC ACID COMPOUNDS AND DERIVATIVES THEREOF JEMLAN, LLC (US) 2000-09-26 US disclosed
EP-0475160-B1 Preparation for drug application in minute droplet form IDEA AG (DE) 1996-02-14 EP disclosed
EP-0475160-A1 Preparation for drug application in minute droplet form Cevc, Gregor, Prof. Dr. (DE) 1992-03-18 EP disclosed