SCHEMBL16980602

SCHEMBL16980602

CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#CC#C[C@H]1OC(C)(C)O[C@H]1C(=O)N[C@@H](COC1OC(COCc2ccccc2)C(C)C(C)C1C)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](CCCCCCCCCCCCCC)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 6/20 0.34
▸ NT5E P21589 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
SCHEMBL16980616 0.86 SELP (0.33) SELP
SCHEMBL14477819 0.82 SELP (0.37) SELP
SCHEMBL16980609 0.81 SELP (0.39) SELP
SCHEMBL14477827 0.77 SELP (0.32) SELP
SCHEMBL16980592 0.77 SELP (0.32) SELP
SCHEMBL17035838 0.75 SELP (0.40) SELP
SCHEMBL18807271 0.74 SELP (0.33) SELP
SCHEMBL17035892 0.73 SELP (0.38) SELP
SCHEMBL17035891 0.72 SELP (0.37) SELP
SCHEMBL12632769 0.72 SELP (0.40) SELP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464105-B2 Hydroxylated KRN7000 analogue and use thereof RIKEN (JP) 2016-10-11 — — US disclosed
US-20150218199-A1 HYDROXYLATED KRN7000 ANALOGUE AND USE THEREOF RIKEN (JP) 2015-08-06 — — 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-20150218199-A1 HYDROXYLATED KRN7000 ANALOGUE AND USE THEREOF PHF20, KLF10, AKR1B10 SELP 1355/4885NT5E 3695/4885

“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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