SCHEMBL790021

SCHEMBL790021

CC(C)CC(NC(C)C)C(=O)OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPR3 P17342 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
FOLH1 Q04609 6/20 0.39
BIRC2 Q13490 2/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TSHR P16473 1/20 0.34
MAPT P10636 1/20 0.34
MME P08473 1/20 0.33
POLB P06746 1/20 0.33
ANPEP P15144 1/20 0.33

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
SCHEMBL790384 1.00 NPR3 (0.41) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL789730 1.00 NPR3 (0.41) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL19861842 0.86 FOLH1 (0.35) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL23520088 0.86 FOLH1 (0.35) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL22503353 0.86 NPR3 (0.35) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL20017106 0.85 BIRC2 (0.38) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL22364068 0.85 BIRC2 (0.38) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL22004937 0.83 TAS1R3 (0.47) ALDH1A1MEN1LMNAKMT2AFOLH1
SCHEMBL18877136 0.83 NPR3 (0.34) NPR3ALDH1A1MEN1LMNAKMT2A
SCHEMBL18671872 0.82 TDP1 (0.34) NPR3FOLH1TSHR

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 78 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773126-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Pharmaceuticals, Inc. (US) 2023-10-03 US disclosed
US-20230167151-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF JANSSEN PHARMACEUTICA NV (BE) 2023-06-01 US disclosed
US-20230167151-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF JANSSEN PHARMACEUTICA NV (BE) 2023-06-01 US disclosed
US-11365202-B2 Antimalarial compounds, process for preparation and their use for drug resistant malaria COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2022-06-21 US disclosed
US-20210179656-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. (US) 2021-06-17 US disclosed
US-11021509-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2021-06-01 US disclosed
US-20210139523-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. (US) 2021-05-13 US disclosed
US-20210106604-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2021-04-15 US disclosed
US-10793591-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2020-10-06 US disclosed
US-10780105-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2020-09-22 US disclosed
US-20150051167-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2015-02-19 US disclosed
US-20150011497-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-01-08 US disclosed
US-20150005251-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF JANSSEN PHARMACEUTICA NV 2015-01-01 US disclosed
US-8871737-B2 Substituted nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2014-10-28 US disclosed
US-20140179910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2014-06-26 US disclosed
US-20140179627-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2014-06-26 US disclosed
US-20130164261-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2013-06-27 US disclosed
US-20130165400-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2013-06-27 US disclosed
US-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 US disclosed
US-20120071434-A1 SUBSTITUTED NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. (US) 2012-03-22 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 (18 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-20140179910-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 NPR3 1695/4885ALDH1A1 1431/4885MEN1 4103/4885
US-20140179627-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 NPR3 1695/4885ALDH1A1 1431/4885MEN1 4103/4885
US-20230167151-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 NPR3 1695/4885ALDH1A1 1431/4885MEN1 4103/4885
US-11021509-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NT5C3B, ADAR NPR3 1659/4885ALDH1A1 3576/4885MEN1 3489/4885
US-11365202-B2 Antimalarial compounds, process for preparation and their use for drug resistant malaria DPP4, DPP7, DPP9 NPR3 3521/4885ALDH1A1 391/4885MEN1 2347/4885
US-20130165400-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR NPR3 1659/4885ALDH1A1 3576/4885MEN1 3489/4885
US-20130164261-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NUDT1, TYMP NPR3 2947/4885ALDH1A1 2567/4885MEN1 1839/4885
US-20150051167-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR NPR3 1659/4885ALDH1A1 3576/4885MEN1 3489/4885
US-20210179656-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, ADAR NPR3 1659/4885ALDH1A1 3576/4885MEN1 3489/4885
US-20120071434-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NUDT1, TYMP NPR3 2947/4885ALDH1A1 2567/4885MEN1 1839/4885
US-11773126-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, TYMP, SLC29A1 NPR3 1734/4885ALDH1A1 1173/4885MEN1 3311/4885
US-20210139523-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C2 NPR3 1695/4885ALDH1A1 1431/4885MEN1 4103/4885
US-20120070411-A1 SUBSTITUTED NUCLEOTIDE ANALOGS PNP, NTPCR, NUDT1 NPR3 2249/4885ALDH1A1 2210/4885MEN1 1646/4885
US-10780105-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NUDT1, NT5C3B NPR3 1117/4885ALDH1A1 2125/4885MEN1 3432/4885
US-20150005251-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, NT5C2 NPR3 1978/4885ALDH1A1 3169/4885MEN1 3340/4885
US-20150011497-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B NPR3 1100/4885ALDH1A1 1153/4885MEN1 4230/4885
US-10793591-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, NUDT1, NT5C2 NPR3 1695/4885ALDH1A1 1431/4885MEN1 4103/4885
US-20210106604-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B NPR3 1117/4885ALDH1A1 2125/4885MEN1 3432/4885

“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.