SCHEMBL6834890

SCHEMBL6834890

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nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.38
CYP2D6 P10635 1/20 0.35
THRB P10828 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL6834894 1.00 ABCB1 (0.38) ABCB1CYP2D6THRBHSD17B10
SCHEMBL9744786 0.87 ABCB1 (0.40) ABCB1CYP2D6THRBHSD17B10
SCHEMBL9744999 0.87 ABCB1 (0.40) ABCB1CYP2D6THRBHSD17B10
SCHEMBL9744773 0.87 ABCB1 (0.40) ABCB1CYP2D6THRBHSD17B10
SCHEMBL21694329 0.86 ABCB1 (0.38) ABCB1CYP2D6THRBHSD17B10
SCHEMBL4618909 0.81 ABCB1 (0.37) ABCB1
SCHEMBL16373895 0.81 ABCB1 (0.35) ABCB1
SCHEMBL4618913 0.81 ABCB1 (0.37) ABCB1
SCHEMBL6839082 0.79 ABCB1 (0.49) ABCB1CYP2D6THRBHSD17B10
SCHEMBL21694355 0.79 ABCB1 (0.49) ABCB1CYP2D6THRBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10780105-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2020-09-22 US disclosed
US-20190054108-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2019-02-21 US disclosed
WO-2015200219-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2015-12-30 WO disclosed
WO-2015200205-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2015-12-30 WO disclosed
US-20040229840-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase ISIS PHARMACEUTICALS, INC. 2004-11-18 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 (3 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-20190054108-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B ABCB1 689/4885CYP2D6 3004/4885THRB 2519/4885
US-20040229840-A1 Nucleoside derivatives as inhibitors of RNA-dependent RNA viral polymerase NSUN2, NSUN3, POLRMT ABCB1 592/4885CYP2D6 2332/4885THRB 4665/4885
US-10780105-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NUDT1, NT5C3B ABCB1 689/4885CYP2D6 3004/4885THRB 2519/4885

“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.