SCHEMBL31317971

SCHEMBL31317971

CC(C)(C)OC(=O)CC[C@H](NC(=O)N[C@@H](CCC(=O)N[C@@H](CCCCNC(=O)CCCc1ccc([Sn](C)(C)C)cc1)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 8/20 0.43
▸ POLB P06746 2/20 0.38
▸ TDP1 Q9NUW8 4/20 0.38
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ PAX8 Q06710 2/20 0.36
▸ FOLH1 Q04609 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ P2RY12 Q9H244 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL31317984 0.97 ALB (0.45) ALBPOLBTDP1CA1CA2
SCHEMBL31318002 0.95 ALB (0.41) ALBPOLBTDP1CA1CA2
SCHEMBL31317985 0.93 POLB (0.40) ALBPOLBTDP1CA1CA2
SCHEMBL31317941 0.89 POLB (0.41) POLBTDP1CA1CA2ATM
SCHEMBL19743079 0.88 ALB (0.52) ALBFOLH1
SCHEMBL19743081 0.88 ALB (0.52) ALBFOLH1
SCHEMBL19743137 0.85 ALB (0.48) ALBFOLH1
SCHEMBL19743136 0.85 ALB (0.48) ALBFOLH1
SCHEMBL19743134 0.84 FOLH1 (0.50) ALBFOLH1
SCHEMBL19743135 0.84 FOLH1 (0.50) ALBFOLH1

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-20260091008-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL CORNELL UNIVERSITY (US) 2026-04-02 — — US disclosed
EP-4520745-A2 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL Cornell University (US) 2025-03-12 — — EP disclosed
EP-3474903-B1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL UNIV CORNELL (US) 2025-01-22 — — EP disclosed
US-12186288-B2 Double targeted constructs to affect tumor kill CORNELL UNIVERSITY (US) 2025-01-07 — — 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 (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-20260091008-A1 DOUBLE TARGETED CONSTRUCTS TO AFFECT TUMOR KILL PSMA2, CD47, KLK3 ALB 1858/4885POLB 2833/4885TDP1 2617/4885
US-12186288-B2 Double targeted constructs to affect tumor kill PSMA2, FOLH1, KLK3 ALB 1812/4885POLB 1548/4885TDP1 3365/4885

“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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