SCHEMBL17167809

SCHEMBL17167809

N#CCCOCC(COCCC(=O)O)(COCCC(=O)O)COCCC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.33
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL17167156 0.92 MEN1 (0.36) MEN1KMT2A
SCHEMBL11592610 0.86 MMP2 (0.37) MMP2TSHRMEN1KMT2A
SCHEMBL10215089 0.84 LMNA (0.40) TSHRKMT2A
SCHEMBL1344130 0.82 ALDH1A1 (0.37) TSHR
SCHEMBL18090272 0.81 TSHR (0.43) TSHRMEN1KMT2A
SCHEMBL7754985 0.81 TSHR (0.39) TSHRMEN1KMT2A
SCHEMBL13813150 0.80 ALDH1A1 (0.35)
SCHEMBL6284087 0.76 TSHR (0.48) TSHRKMT2A
SCHEMBL18090265 0.75 TSHR (0.38) TSHR
SCHEMBL18090267 0.75 TSHR (0.38) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9879041-B2 Saccharide dendritic cluster compounds as inhibitors of BACE-1 VICTORIA LINK LIMITED (NZ) 2018-01-30 US disclosed
US-20170152279-A9 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 UNIVERSITY OF LIVERPOOL (GB) 2017-06-01 US disclosed
US-20150291644-A1 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 VICTORIA LINK LTD (NZ) 2015-10-15 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 (2 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-20150291644-A1 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 BACE1, BACE2, APP MMP2 885/4885TSHR 4758/4885MEN1 1407/4885
US-20170152279-A9 Saccharide Dendritic Cluster Compounds as Inhibitors of Bace-1 BACE1, BACE2, APP MMP2 885/4885TSHR 4758/4885MEN1 1407/4885

“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.