SCHEMBL21534468

SCHEMBL21534468

CC(=O)N[C@H](C(=O)N[C@@H](CCCCNC(N)=O)C(C)=O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SIRT5 Q9NXA8 4/20 0.48
▸ SIRT6 Q8N6T7 1/20 0.44
▸ SIRT1 Q96EB6 1/20 0.44
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ ALB P02768 1/20 0.39
▸ FURIN P09958 6/20 0.37
▸ FOLH1 Q04609 1/20 0.37
▸ PCSK6 P29122 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ IGF2R P11717 1/20 0.35
▸ PTPN2 P17706 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL17993275 0.96 SIRT5 (0.44) SIRT5SIRT6SIRT1SIRT2ALB
SCHEMBL25092038 0.96 SIRT5 (0.44) SIRT5SIRT6SIRT1SIRT2ALB
SCHEMBL17841852 0.90 SIRT5 (0.49) SIRT5SIRT6SIRT1SIRT2ALB
SCHEMBL19776854 0.90 SIRT5 (0.49) SIRT5SIRT6SIRT1SIRT2ALB
SCHEMBL19171358 0.86 SIRT5 (0.40) SIRT5SIRT6SIRT1SIRT2FURIN
SCHEMBL18688864 0.86 GNPAT (0.45) SIRT5SIRT6SIRT1ALBFURIN
SCHEMBL28574926 0.86 GNPAT (0.45) SIRT5SIRT6SIRT1ALBFURIN
SCHEMBL18122890 0.85 SIRT5 (0.37) SIRT5SIRT6SIRT1SIRT2FURIN
SCHEMBL29296435 0.85 SIRT5 (0.41) SIRT5SIRT6SIRT1SIRT2FURIN
SCHEMBL18661755 0.85 SIRT5 (0.36) SIRT5SIRT6SIRT1FURINKMT2A

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-10463749-B2 Maytansinoid derivatives, conjugates thereof, and methods of use REGENERON PHARMACEUTICALS, INC. (US) 2019-11-05 — — 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-10463749-B2 Maytansinoid derivatives, conjugates thereof, and methods of use HNMT, SLC10A1, SLC10A2 SIRT5 2864/4885SIRT6 3131/4885SIRT1 1931/4885

“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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