SCHEMBL20180333

SCHEMBL20180333

CC(=O)NC1C(O)[C@H](O)C(CO)O[C@@H]1O[C@@H]1C(C(=O)O)O[C@@H](O[C@@H]2C(CO)O[C@H](O[C@@H]3C(C(=O)O)O[C@@H](OCCN)[C@@H](O)C3O)C(NC(C)=O)C2O)C(O)C1O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 2/20 0.58
LGALS3 P17931 2/20 0.58
LGALS4 P56470 2/20 0.58
IGF2R P11717 2/20 0.52
MDK P21741 3/20 0.49
MAPK1 P28482 1/20 0.49
CHIA Q9BZP6 1/20 0.49
HPSE Q9Y251 5/20 0.48
CD69 Q07108 1/20 0.47
BDNF P23560 2/20 0.46
PTN P21246 1/20 0.46
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44

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
SCHEMBL16063765 1.00 LGALS8 (0.58) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL18494404 0.94 LGALS3 (0.56) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL16063647 0.94 LGALS3 (0.53) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL18494820 0.94 LGALS3 (0.53) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL18494405 0.94 LGALS3 (0.53) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL19726142 0.88 LGALS3 (0.73) LGALS8LGALS3LGALS4IGF2RMAPK1
SCHEMBL16996680 0.88 LGALS3 (0.58) LGALS8LGALS3LGALS4IGF2RMDK
SCHEMBL27433373 0.88 LGALS3 (0.56) LGALS8LGALS3LGALS4MDKMAPK1
SCHEMBL21321488 0.87 IGF2R (0.65) LGALS8LGALS3LGALS4IGF2RHPSE
SCHEMBL21233299 0.87 IGF2R (0.65) LGALS8LGALS3LGALS4IGF2RHPSE

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
US-20180142227-A1 COAGULATION FACTOR VII POLYPEPTIDES NOVO NORDISK HEALTHCARE AG (CH) 2018-05-24 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-20180142227-A1 COAGULATION FACTOR VII POLYPEPTIDES F7, F13B, HABP2 LGALS8 1604/4885LGALS3 2458/4885LGALS4 2259/4885

“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.