SCHEMBL28064130

SCHEMBL28064130

COC(=O)c1csc([C@@H](C[C@@H](NC(=O)OC(C)(C)C)C(C)C)O[Si](C)(C)C(C)(C)C)n1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 6/20 0.52
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA4 P22748 1/20 0.34
CA9 Q16790 1/20 0.34
PTPRB P23467 9/20 0.34
BACE1 P56817 3/20 0.34
CTSD P07339 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34

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
SCHEMBL28064131 1.00 ABCB1 (0.52) ABCB1CA1CA2CA7CA4
SCHEMBL24140420 0.93 ABCB1 (0.62) ABCB1CA1CA2CA7PTPRB
SCHEMBL15433017 0.86 ABCB1 (0.53) ABCB1CA1CA2CA7CA4
SCHEMBL15236993 0.86 ABCB1 (0.53) ABCB1CA1CA2CA7CA4
SCHEMBL18928619 0.86 ABCB1 (0.53) ABCB1CA1CA2CA7CA4
SCHEMBL13108147 0.84 ABCB1 (0.54) ABCB1CA1CA2CA7CA4
SCHEMBL18928362 0.84 ABCB1 (0.54) ABCB1CA1CA2CA7CA4
SCHEMBL15432495 0.84 ABCB1 (0.54) ABCB1CA1CA2CA7CA4
SCHEMBL28634475 0.82 ABCB1 (0.38) ABCB1CA2PTPRB
SCHEMBL28634476 0.82 ABCB1 (0.38) ABCB1CA2PTPRB

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-12144864-B2 Tubulysins and protein-tubulysin conjugates REGENERON PHARMACEUTICALS, INC. (US) 2024-11-19 US disclosed
CN-113454097-A Tubulysins and protein-tubulysin conjugates 里珍纳龙药品有限公司 2021-09-28 CN disclosed
CN-103333133-B The synthetic method of a kind of Tubulysin family compound key intermediate TUV 西北师范大学 2016-06-08 CN 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-12144864-B2 Tubulysins and protein-tubulysin conjugates SDCBP, TEK, TEKT1 ABCB1 895/4885CA1 3635/4885CA2 3368/4885

“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.