SCHEMBL20819155

SCHEMBL20819155

N#CC1(CO)O[C@@](C#N)(c2ccc3c(NC(=O)c4ccccc4)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.56
▸ EGLN2 Q96KS0 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ RIPK1 Q13546 2/20 0.32
▸ ADORA3 P0DMS8 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ CSF1R P07333 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ CTSL P07711 1/20 0.30
▸ CTSB P07858 1/20 0.30
▸ CTSK P43235 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
SCHEMBL24791785 0.82 TMPRSS2 (0.79) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL25909952 0.80 TMPRSS2 (0.68) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL16710418 0.80 TMPRSS2 (0.51) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL16710856 0.80 TMPRSS2 (0.51) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL24789731 0.78 TMPRSS2 (0.64) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL19101807 0.78 TMPRSS2 (0.48) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL24917569 0.78 TMPRSS2 (0.63) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL26136380 0.78 TMPRSS2 (0.63) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL24667606 0.78 TMPRSS2 (0.65) TMPRSS2EGLN2TDP1NPC1ALDH1A1
SCHEMBL25315489 0.77 TMPRSS2 (0.62) TMPRSS2EGLN2TDP1NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111542531-B Substituted nucleosides, nucleotides and analogues thereof 詹森生物制药有限公司 2024-07-19 — — CN disclosed
US-11773126-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Pharmaceuticals, Inc. (US) 2023-10-03 — — US disclosed
US-20210395288-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF JANSSSEN BIOPHARMA, INC. (US) 2021-12-23 — — US disclosed
US-11149049-B2 Substituted nucleosides, nucleotides and analogs thereof Janssen Biopharma, Inc. (US) 2021-10-19 — — US disclosed
US-20200277321-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF Janssen Pharmaceuticals, Inc. 2020-09-03 — — US disclosed
EP-3684782-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen BioPharma, Inc. (US) 2020-07-29 — — EP disclosed
WO-2019053696-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF ALIOS BIOPHARMA, INC. (US) 2019-03-21 — — WO 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 (4 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-20200277321-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF PNP, RNGTT, NT5C3B TMPRSS2 664/4885EGLN2 3443/4885TDP1 623/4885
US-11773126-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, TYMP, SLC29A1 TMPRSS2 867/4885EGLN2 3168/4885TDP1 347/4885
US-20210395288-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALAOGS THEREOF PNP, RNGTT, NT5C3B TMPRSS2 664/4885EGLN2 3443/4885TDP1 623/4885
US-11149049-B2 Substituted nucleosides, nucleotides and analogs thereof PNP, TYMP, SLC29A1 TMPRSS2 867/4885EGLN2 3168/4885TDP1 347/4885

“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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