SCHEMBL22307883

SCHEMBL22307883

C/C(=C\[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)[C@@H](N(C)P)C(C)(C)O)C(C)(C)C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TUBB1 Q9H4B7 2/20 0.57
▸ PDF Q9HBH1 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
SCHEMBL24574423 0.89 TUBB1 (0.46) TUBB1
SCHEMBL24575110 0.89 TUBB1 (0.47) TUBB1
SCHEMBL26606699 0.86 TUBB1 (0.61) TUBB1PDF
SCHEMBL24360627 0.84 TUBB1 (0.70) TUBB1PDF
SCHEMBL22308454 0.83 TUBB1 (0.43) TUBB1
SCHEMBL58040 0.82 TUBB1 (0.66) TUBB1PDF
SCHEMBL14567801 0.82 TUBB1 (0.66) TUBB1PDF
SCHEMBL13660110 0.82 TUBB1 (0.66) TUBB1PDF
SCHEMBL58085 0.82 TUBB1 (0.74) TUBB1PDF
SCHEMBL13660108 0.82 TUBB1 (0.74) TUBB1PDF

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 4 patents. 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
US-20220144889-A1 Hemiasterlin Derivative Having Cysteine Residue SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-05-12 — — US disclosed
US-20220125941-A1 Hemiasterlin Derivative and Antibody-Drug Conjugate Thereof SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2022-04-28 — — US disclosed
US-20200247847-A1 Antibody-Drug Conjugates Including Hemiasterlin Derivative SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-08-06 — — 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 (4 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-20220144889-A1 Hemiasterlin Derivative Having Cysteine Residue SHBG, CYP11A1, CYP11B1 TUBB1 1472/4885PDF 1478/4885
US-20220202948-A1 Agent for Eliminating Pluripotent Stem Cells POU5F1, POU2F1, POU2F2 TUBB1 119/4885PDF 4784/4885
US-20200247847-A1 Antibody-Drug Conjugates Including Hemiasterlin Derivative HSD3B2, HSD3B1, HSD11B2 TUBB1 624/4885PDF 3611/4885
US-20220125941-A1 Hemiasterlin Derivative and Antibody-Drug Conjugate Thereof SHBG, HSD17B7, CYP17A1 TUBB1 802/4885PDF 3740/4885

“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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