SCHEMBL27443608

SCHEMBL27443608

CN[C@@H](CCC(=O)NC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.36
▸ GPBAR1 Q8TDU6 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDE4A P27815 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ MMP2 P08253 1/20 0.30
▸ MMP9 P14780 1/20 0.30
▸ MMP8 P22894 1/20 0.30
▸ MMP12 P39900 1/20 0.30
▸ MMP14 P50281 1/20 0.30

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
SCHEMBL27448156 1.00 KDM4E (0.41) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL23813803 0.88 KDM4E (0.37) KDM4EALDH1A1GPBAR1PDE4A
SCHEMBL31370383 0.86 KDM4E (0.43) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL26533468 0.86 KDM4E (0.43) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL25950269 0.86 KDM4E (0.43) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL27315841 0.86 KDM4E (0.43) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL22738631 0.81 KDM4E (0.46) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL17813050 0.78 KDM4E (0.43) KDM4EALDH1A1GPBAR1SMN1; SMN2PDE4A
SCHEMBL20224631 0.78 KDM4E (0.38) KDM4EALDH1A1GPBAR1PDE4ALMNA
SCHEMBL29300253 0.76 NMT2 (0.35) KDM4EALDH1A1GPBAR1

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-12029736-B2 Camptothecin derivatives and conjugates thereof MEDIBOSTON LIMITED (HK) 2024-07-09 — — 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-12029736-B2 Camptothecin derivatives and conjugates thereof TOP2A, TOP1, XPA KDM4E 3831/4885ALDH1A1 1163/4885GPBAR1 3749/4885

“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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