SCHEMBL16772368

SCHEMBL16772368

CCCCCCCCCCCCCC[C@@H](OCc1ccccc1)[C@@H](OCc1ccccc1)[C@H](CO[C@H]1OC(COC(=O)N2CCCCC2)[C@H](C)[C@H](C)C1C)N=[N+]=[N-]

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SELP P16109 6/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP2D6 P10635 2/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ CCR5 P51681 2/20 0.31
▸ BCHE P06276 2/20 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
SCHEMBL16772369 0.87 SELP (0.35) SELPALDH1A1CYP2D6CYP2C9MAPK1
SCHEMBL16772390 0.86 SELP (0.33) SELPALDH1A1CYP2D6MAPK1BCHE
SCHEMBL16772388 0.84 SELP (0.39) SELPCYP2C9
SCHEMBL16772382 0.84 SELP (0.39) SELPCYP2C9
SCHEMBL16772374 0.81 SELP (0.32) SELP
SCHEMBL27054999 0.79 SELP (0.37) SELPALDH1A1CYP2D6CYP2C9MAPK1
SCHEMBL15199322 0.77 SELP (0.35) SELPBCHE
SCHEMBL27055012 0.77 SELP (0.42) SELPCYP2C9BCHE
SCHEMBL27054862 0.76 SELP (0.37) SELPBCHE
SCHEMBL30829360 0.76 SELP (0.41) SELPALDH1A1CYP2D6MAPK1

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-9493497-B2 Carbamate glycolipid and use thereof RIKEN (JP) 2016-11-15 — — US disclosed
US-20150152128-A1 NEW CARBAMATE GLYCOLIPID AND USE THEREOF RIKEN (JP) 2015-06-04 — — 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-20150152128-A1 NEW CARBAMATE GLYCOLIPID AND USE THEREOF SGMS1, CD14, SGMS2 SELP 2028/4885ALDH1A1 3608/4885CYP2D6 4652/4885

“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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