SCHEMBL25444783

SCHEMBL25444783

CC(C)(C)OC(=O)[C@H](N)CNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.50
▸ EPHX2 P34913 1/20 0.45
▸ CASP3 P42574 1/20 0.43
▸ BMP1 P13497 1/20 0.41
▸ MDM4 O15151 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ MDM2 Q00987 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
SCHEMBL26970068 1.00 KMT2A (0.50) KMT2AEPHX2CASP3BMP1MDM4
SCHEMBL17106632 1.00 KMT2A (0.50) KMT2AEPHX2CASP3BMP1MDM4
Hydrochloric Acid SCHEMBL25171597 0.99 KMT2A (0.49) KMT2AEPHX2CASP3BMP1MDM4
Hydrochloric Acid SCHEMBL25171596 0.99 KMT2A (0.49) KMT2AEPHX2CASP3BMP1MDM4
SCHEMBL5631609 0.88 KMT2A (0.54) KMT2AEPHX2CASP3BMP1
SCHEMBL5629775 0.88 KMT2A (0.54) KMT2AEPHX2CASP3BMP1
Hydrochloric Acid SCHEMBL29902249 0.88 KMT2A (0.52) KMT2AEPHX2CASP3MDM2
Hydrochloric Acid SCHEMBL5629771 0.87 KMT2A (0.53) KMT2AEPHX2CASP3BMP1
Hydrochloric Acid SCHEMBL5629777 0.87 KMT2A (0.53) KMT2AEPHX2CASP3BMP1
SCHEMBL16623132 0.87 KMT2A (0.55) KMT2AEPHX2CASP3BMP1MDM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144324-A1 PCSK9 ANTAGONIST COMPOUNDS MERCK SHARP & DOHME LLC 2023-05-11 — — 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 (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-20230144324-A1 PCSK9 ANTAGONIST COMPOUNDS PCSK9, PCSK7, PCSK6 KMT2A 1269/4885EPHX2 1990/4885CASP3 2101/4885

“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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