SCHEMBL25361987

SCHEMBL25361987

Cc1ccc(C(NCCCCC(NC(=O)C(NC(=O)CCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])C(C)C)C(=O)Nc2ccc(C(=O)O)cc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 6/20 0.37
▸ ALB P02768 2/20 0.35
▸ PLG P00747 1/20 0.34
▸ FOLH1 Q04609 2/20 0.34
▸ SIRT2 Q8IXJ6 5/20 0.32
▸ SIRT1 Q96EB6 5/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ SIRT5 Q9NXA8 1/20 0.32

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
SCHEMBL25361975 1.00 FURIN (0.37) FURINALBPLGFOLH1SIRT2
SCHEMBL25360099 0.95 FURIN (0.36) FURINALBPLGSIRT2SIRT1
SCHEMBL25360091 0.95 FURIN (0.36) FURINALBPLGSIRT2SIRT1
SCHEMBL25361536 0.94 SIRT5 (0.38) FURINALBFOLH1SIRT2SIRT1
SCHEMBL25361554 0.94 SIRT5 (0.38) FURINALBFOLH1SIRT2SIRT1
SCHEMBL25350530 0.93 FURIN (0.35) FURINALBSIRT2SIRT1SIRT5
SCHEMBL29048536 0.93 FURIN (0.37) FURINALBFOLH1SIRT2SIRT1
SCHEMBL25383060 0.93 FURIN (0.37) FURINALBFOLH1SIRT2SIRT1
SCHEMBL25361835 0.92 FURIN (0.34) FURINALBSIRT2SIRT1
SCHEMBL25361974 0.89 FURIN (0.34) FURINALBSIRT2SIRT1

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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF ELUCIDA ONCOLOGY, INC. 2023-08-03 — — 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-20230241243-A1 CARRIER PARTICLE-DRUG CONJUGATES, SELF-IMMOLATIVE LINKERS, AND USES THEREOF NDC1, KIFC1, SDCBP FURIN 2087/4885ALB 2187/4885PLG 810/4885

“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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