SCHEMBL23900963

SCHEMBL23900963

CC(C)NC(C(=O)NC(CCCNC(N)=O)C(=O)NC(C)I)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 7/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.34
▸ NMT2 O60551 1/20 0.32
▸ NMT1 P30419 1/20 0.32
▸ C3AR1 Q16581 1/20 0.32
▸ NPY4R P50391 7/20 0.32
▸ NPY1R P25929 5/20 0.32
▸ NPY2R P49146 3/20 0.32
▸ NPY5R Q15761 3/20 0.32
▸ SIRT6 Q8N6T7 1/20 0.32
▸ SIRT1 Q96EB6 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
SCHEMBL23126444 0.91 FURIN (0.38) FURINSIRT5NMT2NMT1C3AR1
SCHEMBL22067692 0.91 FURIN (0.38) FURINSIRT5NMT2NMT1C3AR1
SCHEMBL21788282 0.91 FURIN (0.38) FURINSIRT5NMT2NMT1C3AR1
SCHEMBL23079360 0.86 FURIN (0.39) FURINSIRT5NMT2NMT1C3AR1
SCHEMBL22692383 0.86 C3AR1 (0.34) FURINSIRT5C3AR1SIRT6SIRT1
SCHEMBL22139609 0.86 SIRT5 (0.36) FURINSIRT5C3AR1NPY4RNPY1R
SCHEMBL24173258 0.86 C3AR1 (0.34) FURINSIRT5C3AR1SIRT6SIRT1
SCHEMBL24349699 0.86 SIRT5 (0.36) FURINSIRT5C3AR1NPY4RNPY1R
SCHEMBL22198634 0.86 C3AR1 (0.34) FURINSIRT5C3AR1SIRT6SIRT1
SCHEMBL20803561 0.86 C3AR1 (0.34) FURINSIRT5C3AR1SIRT6SIRT1

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-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2021-10-07 — — 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 (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-20210308277-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS CD2BP2, DCLRE1A, EPCAM FURIN 1909/4885SIRT5 1752/4885NMT2 208/4885

“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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