SCHEMBL20385879

SCHEMBL20385879

CCCCC(CCCC)C(=O)[C@@H](CCCNC(N)=O)NC(=O)C(NC)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ DPP7 Q9UHL4 1/20 0.36
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ USP2 O75604 1/20 0.34
▸ CTSS P25774 1/20 0.34
▸ CTSK P43235 1/20 0.34
▸ PDF Q9HBH1 1/20 0.34
▸ FURIN P09958 2/20 0.33
▸ BIRC2 Q13490 1/20 0.33
▸ NOD1 Q9Y239 1/20 0.33
▸ C3AR1 Q16581 1/20 0.33
▸ REN P00797 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL22001947 0.87 C3AR1 (0.34) SMN1; SMN2SIRT6SIRT1FURINC3AR1
SCHEMBL24490420 0.87 C3AR1 (0.34) SMN1; SMN2SIRT6SIRT1FURINC3AR1
SCHEMBL21915057 0.87 C3AR1 (0.34) SMN1; SMN2SIRT6SIRT1FURINC3AR1
SCHEMBL24172601 0.87 SMN1; SMN2 (0.37) SMN1; SMN2DPP7SIRT6SIRT1CA1
SCHEMBL21152822 0.86 SIRT6 (0.44) SMN1; SMN2DPP7SIRT6SIRT1FURIN
SCHEMBL18818915 0.85 REN (0.34) SMN1; SMN2SIRT6SIRT1FURINC3AR1
SCHEMBL1711520 0.85 C3AR1 (0.44) SMN1; SMN2FURINNOD1C3AR1
SCHEMBL1711524 0.85 C3AR1 (0.44) SMN1; SMN2FURINNOD1C3AR1
SCHEMBL23393940 0.83 SIRT5 (0.39) SMN1; SMN2FURINNOD1C3AR1
SCHEMBL24571690 0.83 FURIN (0.37) SMN1; SMN2DPP7SIRT6SIRT1FURIN

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-20180200378-A1 COMPOUNDS FOR TREATING CANCER Bicyclerd Limited (GB) 2018-07-19 — — 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-20180200378-A1 COMPOUNDS FOR TREATING CANCER TP53, VHL, MYC SMN1; SMN2 3956/4885DPP7 3309/4885SIRT6 1621/4885

“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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