SCHEMBL21534451

SCHEMBL21534451

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ C3AR1 Q16581 1/20 0.36
▸ DPP7 Q9UHL4 1/20 0.33
▸ SIRT5 Q9NXA8 1/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ SIRT1 Q96EB6 1/20 0.33
▸ DDAH1 O94760 1/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ ALB P02768 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ FOLH1 Q04609 1/20 0.31
▸ PAOX Q6QHF9 3/20 0.31
▸ OTC P00480 1/20 0.30
▸ KISS1R Q969F8 1/20 0.30
▸ SHMT1 P34896 1/20 0.30

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
SCHEMBL29335384 0.86 KDM4E (0.47) DPP7SIRT5SIRT6SIRT1KDM4E
SCHEMBL17326511 0.82 SIRT5 (0.34) C3AR1SIRT5SIRT6SIRT1KISS1R
SCHEMBL8298580 0.81 KDM4E (0.50) DPP7SIRT5SIRT6SIRT1ALB
SCHEMBL15315075 0.81 C3AR1 (0.38) C3AR1DPP7SIRT5SIRT6SIRT1
SCHEMBL15691795 0.81 C3AR1 (0.38) C3AR1DPP7SIRT5SIRT6SIRT1
SCHEMBL10441955 0.81 C3AR1 (0.38) C3AR1DPP7SIRT5SIRT6SIRT1
SCHEMBL24135883 0.80 C3AR1 (0.41) C3AR1DPP7DDAH1CTDSP1FOLH1
SCHEMBL21152967 0.78 C3AR1 (0.36) C3AR1DPP7SIRT5SIRT6SIRT1
SCHEMBL24420994 0.78 C3AR1 (0.36) C3AR1DPP7SIRT5SIRT6SIRT1
SCHEMBL17210488 0.77 GSR (0.42) DPP7SIRT6SIRT1FOLH1PAOX

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 — — WO disclosed
EP-3169368-B1 LINKERS AND THEIR APPLICATION TOWARDS ADC MEDSHINE DISCOVERY INC (CN) 2021-02-17 — — EP disclosed
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 C3AR1 419/4885DPP7 624/4885SIRT5 2864/4885

“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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