SCHEMBL20180415

SCHEMBL20180415

Nc1ccn(C2OC(COP(=O)(O)O[C@@]3(C(=O)O)C[C@@H](O)C(NC(=O)CNC(=O)CCCS)C(C[C@H](O)CO)O3)C(O)C2O)c(=O)n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ST6GAL1 P15907 10/20 0.43
P2RY2 P41231 4/20 0.42
P2RY4 P51582 3/20 0.41
P2RY6 Q15077 3/20 0.41
TSHR P16473 1/20 0.39
GLA P06280 1/20 0.39

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
SCHEMBL18713166 0.91 ST6GAL1 (0.43) ST6GAL1P2RY2P2RY4P2RY6
SCHEMBL18713167 0.91 ST6GAL1 (0.43) ST6GAL1P2RY2P2RY4P2RY6
SCHEMBL17000271 0.91 ST6GAL1 (0.43) ST6GAL1P2RY2P2RY4P2RY6
SCHEMBL17469520 0.90 P2RY2 (0.46) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL18495198 0.90 P2RY2 (0.46) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL20068332 0.88 P2RY2 (0.43) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL22930844 0.87 ST6GAL1 (0.40) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL24169755 0.85 P2RY2 (0.51) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL24170210 0.85 P2RY2 (0.51) ST6GAL1P2RY2P2RY4P2RY6TSHR
SCHEMBL18713165 0.84 ST6GAL1 (0.42) ST6GAL1P2RY2P2RY4P2RY6TSHR

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 ST6GAL1 524/4885P2RY2 4167/4885P2RY4 3943/4885

“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.