SCHEMBL13896971

SCHEMBL13896971

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nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSK P43235 13/20 0.59
CTSS P25774 8/20 0.59
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CAPN1 P07384 1/20 0.43
CYP2D6 P10635 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL8245652 1.00 CTSK (0.59) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL12965802 1.00 CTSK (0.59) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL5532831 0.87 CTSK (0.58) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL18925259 0.87 CTSK (0.58) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL18892598 0.87 CTSK (0.58) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL23016033 0.85 CTSK (0.61) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL12965804 0.85 CTSK (0.61) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL15435539 0.85 CTSK (0.59) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL1688825 0.85 CTSK (0.59) CTSKCTSSCYP1A2CYP2C9CYP2C19
SCHEMBL318796 0.85 CTSK (0.64) CTSKCTSSCYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230165932-A1 PCSK9 ANTAGONIST COMPOUNDS MERCK SHARP & DOHME LLC 2023-06-01 US disclosed
EP-3490977-B1 CYCLOBUTANE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED POTASSIUM CHANNELS AUTIFONY THERAPEUTICS LTD (GB) 2020-11-25 EP disclosed
EP-2150269-B1 NEW CYCLIC PEPTIDE COMPOUNDS ASTELLAS PHARMA INC (JP) 2012-11-21 EP 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-20230165932-A1 PCSK9 ANTAGONIST COMPOUNDS PCSK9, PCSK7, PCSK6 CTSK 193/4885CTSS 287/4885CYP1A2 3164/4885

“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.