SCHEMBL12880840

SCHEMBL12880840

CC(=O)NC1C(OCCCCCS)OC(CO)C(O)C1OC1OC(CO)C(O)C(O)C1O

nearest known ligand 0.88

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LGALS3 P17931 4/20 0.88
LGALS8 O00214 3/20 0.88
LGALS4 P56470 3/20 0.88
MAPK1 P28482 2/20 0.64
BDNF P23560 3/20 0.48
PTN P21246 2/20 0.48
MDK P21741 2/20 0.48
CD69 Q07108 1/20 0.45
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
IGF2R P11717 1/20 0.43
B4GALT1 P15291 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
SCHEMBL14355305 1.00 LGALS3 (0.88) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL14266909 1.00 LGALS3 (0.88) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL14380157 1.00 LGALS3 (0.88) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL14355296 0.94 LGALS3 (0.79) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL14266900 0.94 LGALS3 (0.79) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL30567492 0.90 MAPK1 (0.79) LGALS3LGALS8LGALS4MAPK1BDNF
SCHEMBL12715043 0.89 LGALS8 (0.80) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL12715191 0.89 LGALS8 (0.80) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL2482720 0.89 LGALS8 (0.80) LGALS3LGALS8LGALS4MAPK1CD69
SCHEMBL14355286 0.89 LGALS8 (0.80) LGALS3LGALS8LGALS4MAPK1CD69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110033954-A1 BIOFUNCTIONALIZED QUANTUM DOTS FOR BIOLOGICAL IMAGING The Government of the United State of America, as Represented by the Secretary, Department of Health (US) 2011-02-10 US disclosed
US-20110033954-A1 BIOFUNCTIONALIZED QUANTUM DOTS FOR BIOLOGICAL IMAGING The Government of the United State of America, as Represented by the Secretary, Department of Health (US) 2011-02-10 US disclosed
US-7790473-B2 Biofunctionalized quantum dots for biological imaging THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-09-07 US disclosed
US-7790473-B2 Biofunctionalized quantum dots for biological imaging THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-09-07 US disclosed
US-20080039816-A1 Carbohydrate-Encapsulated Quantum Dots for Bilogical Imaging The Government of the United States of America as represented by the Secretary, Department of (US) 2008-02-14 US disclosed
US-20080039816-A1 Carbohydrate-Encapsulated Quantum Dots for Bilogical Imaging The Government of the United States of America as represented by the Secretary, Department of (US) 2008-02-14 US disclosed
US-20070172427-A1 Biofunctionalized quantum dots for biological imaging THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEA (US) 2007-07-26 US disclosed
US-20070172427-A1 Biofunctionalized quantum dots for biological imaging THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEA (US) 2007-07-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070172427-A1 Biofunctionalized quantum dots for biological imaging FABP1, FABP7, FABP3 LGALS3 217/4885LGALS8 400/4885LGALS4 109/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.