SCHEMBL24575157

SCHEMBL24575157

CN[C@H](C(=O)NC(C(=O)N(C)[C@H](/C=C(\C)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C)C(C)(C)C)C(C)(C)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 2/20 0.60
▸ FOLH1 Q04609 3/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ ADAMTS4 O75173 1/20 0.34
▸ ADAMTS5 Q9UNA0 1/20 0.34
▸ NAALAD2 Q9Y3Q0 2/20 0.33
▸ MMP2 P08253 8/20 0.33
▸ MMP3 P08254 6/20 0.33
▸ GAA P10253 1/20 0.32
▸ MMP1 P03956 2/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ MMP8 P22894 1/20 0.32

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
SCHEMBL22316491 1.00 TUBB1 (0.60) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL22316492 1.00 TUBB1 (0.60) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL27409361 1.00 TUBB1 (0.60) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL20739123 0.94 TUBB1 (0.61) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL22283982 0.94 TUBB1 (0.61) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL22315894 0.94 TUBB1 (0.61) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL20738986 0.94 TUBB1 (0.53) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL22316586 0.94 TUBB1 (0.53) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL22316587 0.93 TUBB1 (0.54) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5
SCHEMBL20739215 0.93 TUBB1 (0.59) TUBB1FOLH1HDAC1ADAMTS4ADAMTS5

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-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-06-30 — — 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-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells POU5F1, POU2F1, POU2F2 TUBB1 119/4885FOLH1 471/4885HDAC1 357/4885

“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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