SCHEMBL17863951

SCHEMBL17863951

CC(=O)/C=C\N(C(C)=O)[C@@H]1O[C@@](COC(=O)c2ccccc2)(C(F)F)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.35
▸ ABCB1 P08183 11/20 0.33
▸ PRKCA P17252 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
SCHEMBL16214943 0.80 MAPT (0.33) MAPTABCB1
SCHEMBL16377259 0.80 MAPT (0.33) MAPTABCB1
SCHEMBL17863953 0.78 MAPT (0.41) MAPTABCB1
SCHEMBL17860797 0.78 MAPT (0.41) MAPTABCB1
SCHEMBL17359833 0.77 ABCB1 (0.31) MAPTABCB1
SCHEMBL17359834 0.77 ABCB1 (0.31) MAPTABCB1
SCHEMBL15250846 0.76 CYP1A2 (0.31) ABCB1
SCHEMBL16144614 0.74 ALDH1A1 (0.33) PRKCA
SCHEMBL15095554 0.73 USP2 (0.45) —
SCHEMBL17359597 0.73 ALDH1A1 (0.34) ABCB1PRKCA

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-20160176910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. 2016-06-23 — — 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-20160176910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NT5C2 MAPT 3786/4885ABCB1 1275/4885PRKCA 2632/4885

“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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