SCHEMBL18914962

SCHEMBL18914962

COCCCCCC(=O)NCCCCCCCC(=O)NCCCCCCOC1OC(C(=O)O)C(OC2OC(COS(=O)(=O)O)C(O)C(O)C2C)C(O)C1OS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.48
▸ BDNF P23560 3/20 0.47
▸ MDK P21741 3/20 0.47
▸ PTN P21246 2/20 0.47
▸ HPSE Q9Y251 8/20 0.46
▸ FGF1 P05230 4/20 0.46
▸ FGF2 P09038 4/20 0.46
▸ CXCL12 P48061 2/20 0.44
▸ CXCL10 P02778 1/20 0.44
▸ CXCL8 P10145 1/20 0.44
▸ CCL2 P13500 1/20 0.44
▸ CCL5 P13501 1/20 0.44
▸ SERPINC1 P01008 1/20 0.39
▸ VEGFA P15692 2/20 0.38
▸ BMP2 P12643 1/20 0.37
▸ SHH Q15465 1/20 0.37
▸ SELP P16109 1/20 0.36

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
SCHEMBL18914959 0.93 MDK (0.51) F10BDNFMDKPTNHPSE
SCHEMBL18915131 0.91 MDK (0.47) F10BDNFMDKPTNHPSE
SCHEMBL18914964 0.90 MDK (0.47) F10BDNFMDKPTNHPSE
SCHEMBL17167262 0.89 HPSE (0.47) F10BDNFMDKPTNHPSE
SCHEMBL17167846 0.88 MDK (0.44) F10BDNFMDKPTNHPSE
SCHEMBL17167856 0.87 MDK (0.41) F10BDNFMDKPTNHPSE
SCHEMBL17167701 0.87 MDK (0.59) F10BDNFMDKPTNHPSE
SCHEMBL17167549 0.86 F10 (0.44) F10BDNFMDKPTNHPSE
SCHEMBL17167539 0.86 BDNF (0.51) F10BDNFMDKPTNHPSE
SCHEMBL18915130 0.86 MDK (0.49) F10BDNFMDKPTNHPSE

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-20170152279-A9 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 UNIVERSITY OF LIVERPOOL (GB) 2017-06-01 — — 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-20170152279-A9 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 BACE1, BACE2, APP F10 3347/4885BDNF 121/4885MDK 4339/4885

“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.

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