SCHEMBL29947102

SCHEMBL29947102

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nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
NFKB1 P19838 1/20 0.54
PTGS2 P35354 1/20 0.54
THPO P40225 1/20 0.54
RECQL P46063 1/20 0.54
BLM P54132 1/20 0.54
SIRT5 Q9NXA8 2/20 0.46
GNPAT O15228 2/20 0.46
ACE P12821 1/20 0.43
SIRT6 Q8N6T7 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
NPY4R P50391 10/20 0.40
NPY1R P25929 7/20 0.40
NPY5R Q15761 6/20 0.40
NPY2R P49146 3/20 0.40
FOLH1 Q04609 1/20 0.39

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
SCHEMBL29947121 1.00 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947100 1.00 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947125 1.00 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947066 1.00 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947174 0.96 SMN1; SMN2 (0.53) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947289 0.95 KDM4E (0.49) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL6756643 0.95 SMN1; SMN2 (0.50) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947294 0.93 NPY4R (0.49) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL29947120 0.93 NPY4R (0.49) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL1718474 0.92 GNPAT (0.53) SMN1; SMN2KDM4EMAPTTHRBALOX15

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-12365706-B2 Macrocyclic peptides as potent inhibitors of K-RAS G12D mutant MERCK SHARP & DOHME LLC (US) 2025-07-22 US disclosed
US-20230083431-A1 MACROCYCLIC PEPTIDES AS POTENT INHIBITORS OF K-RAS G12D MUTANT MERCK SHARP & DOHME LLC (US) 2023-03-16 US disclosed
EP-4076493-A1 MACROCYCLIC PEPTIDES AS POTENT INHIBITORS OF K-RAS G12D MUTANT Merck Sharp & Dohme LLC (US) 2022-10-26 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 (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-12365706-B2 Macrocyclic peptides as potent inhibitors of K-RAS G12D mutant KRAS, NRAS, HRAS SMN1; SMN2 1207/4885KDM4E 2472/4885MAPT 4728/4885
US-20230083431-A1 MACROCYCLIC PEPTIDES AS POTENT INHIBITORS OF K-RAS G12D MUTANT KRAS, NRAS, HRAS SMN1; SMN2 1207/4885KDM4E 2472/4885MAPT 4728/4885

“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.