SCHEMBL25655950

SCHEMBL25655950

CC(C)N[C@H](C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(C)C)cc1)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 3/20 0.41
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ SIRT2 Q8IXJ6 8/20 0.38
▸ SIRT1 Q96EB6 7/20 0.38
▸ SIRT3 Q9NTG7 3/20 0.38
▸ SIRT5 Q9NXA8 3/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ ADAM10 O14672 1/20 0.36
▸ MMP2 P08253 1/20 0.36
▸ MMP9 P14780 1/20 0.36
▸ MMP12 P39900 1/20 0.36
▸ MMP14 P50281 1/20 0.36
▸ ADAM8 P78325 1/20 0.36
▸ ADAM17 P78536 1/20 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
SCHEMBL16769624 1.00 FURIN (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL22147928 0.91 FURIN (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL25124339 0.91 FURIN (0.43) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL21728798 0.91 SIRT2 (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL18822243 0.90 SIRT2 (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL24220963 0.90 SIRT2 (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL20126461 0.90 SIRT2 (0.41) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL20149172 0.88 FURIN (0.49) FURINHTTSMN1; SMN2SIRT2SIRT1
SCHEMBL22268356 0.88 SIRT2 (0.44) FURINHTTSIRT2SIRT1SIRT3
SCHEMBL24220965 0.88 SIRT2 (0.44) FURINHTTSIRT2SIRT1SIRT3

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-20230173092-A1 ANTIBODY-DRUG CONJUGATES SPIREA LIMITED (GB) 2023-06-08 — — 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-20230173092-A1 ANTIBODY-DRUG CONJUGATES CD44, CD47, FCGR3B FURIN 697/4885HTT 1015/4885SMN1; SMN2 4376/4885

“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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