SCHEMBL23835971

SCHEMBL23835971

CC(C)(C)c1ncc(CN)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39
▸ SCN10A Q9Y5Y9 3/20 0.32
▸ BRS3 P32247 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL1784873 0.86 HRH1 (0.57) HRH1HRH4
SCHEMBL12569335 0.81 DGAT1 (0.33) HRH1HRH4BRS3KCNH2
SCHEMBL21324885 0.78 DAO (0.42) HRH1HRH4BRS3KCNH2
SCHEMBL13188855 0.75 HRH3 (0.46) HRH1HRH4
SCHEMBL21690214 0.75 HRH1 (0.32) HRH1HRH4
SCHEMBL12891057 0.75 HTR1D (0.36) HRH1HRH4KCNH2
SCHEMBL21539011 0.70 BRS3 (0.38) BRS3L3MBTL1
SCHEMBL21539013 0.70 BRS3 (0.33) BRS3
SCHEMBL25758286 0.70 — —
SCHEMBL21325082 0.69 AOC3 (0.33) SCN10AKCNH2

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-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 — — US disclosed
US-11124497-B1 Inhibitors of cysteine proteases and methods of use thereof Pardes Biosciences, Inc. (US) 2021-09-21 — — 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 (2 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-11124497-B1 Inhibitors of cysteine proteases and methods of use thereof CTRL, CTSV, CTSL HRH1 1792/4885HRH4 3076/4885SCN10A 4573/4885
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV HRH1 2966/4885HRH4 4259/4885SCN10A 4257/4885

“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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