SCHEMBL22388613

SCHEMBL22388613

CC(C)(CCOC(C)(C)CCn1cc(CNC(=O)C2CCC(CN3C(=O)C=CC3=O)CC2)nn1)NC(=O)COCC(=O)NC(CCCCN)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 3/20 0.37
▸ TTR P02766 1/20 0.36
▸ IL2 P60568 1/20 0.36
▸ PLG P00747 1/20 0.35
▸ FOLH1 Q04609 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
SCHEMBL22452311 0.87 TTR (0.37) KLKB1TTRIL2PLGFOLH1
SCHEMBL26284929 0.86 TTR (0.37) KLKB1TTRIL2PLGFOLH1
SCHEMBL25795469 0.86 CCKBR (0.35) KLKB1PLGFOLH1
SCHEMBL29351004 0.86 TTR (0.46) KLKB1TTRIL2PLGFOLH1
SCHEMBL26286101 0.84 TTR (0.37) KLKB1TTRIL2PLGFOLH1
SCHEMBL24502762 0.84 TTR (0.36) KLKB1TTRIL2PLG
SCHEMBL24450048 0.84 TTR (0.36) KLKB1TTRIL2PLGFOLH1
SCHEMBL25052808 0.82 TTR (0.37) KLKB1TTRIL2PLGFOLH1
SCHEMBL24335147 0.82 TTR (0.43) KLKB1TTRIL2PLGFOLH1
SCHEMBL26412265 0.82 TTR (0.42) KLKB1TTRIL2PLGFOLH1

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-20200276325-A1 Immunoconjugates with an Intracellularly-Cleavable Linkage IMMUNOMEDICS, INC. 2020-09-03 — — 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-20200276325-A1 Immunoconjugates with an Intracellularly-Cleavable Linkage CD47, CD44, DNPEP KLKB1 314/4885TTR 4028/4885IL2 322/4885

“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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