SCHEMBL27115457

SCHEMBL27115457

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

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ DPP7 Q9UHL4 2/20 0.50
▸ SIRT6 Q8N6T7 1/20 0.50
▸ SIRT1 Q96EB6 1/20 0.50
▸ RRM1 P23921 1/20 0.47
▸ GNAI3 P08754 1/20 0.44
▸ GNAO1 P09471 1/20 0.44
▸ GNAI1 P63096 1/20 0.44
▸ TLR2 O60603 1/20 0.43
▸ MMP8 P22894 1/20 0.41
▸ FNTA P49354 1/20 0.41
▸ FNTB P49356 1/20 0.41
▸ NOD1 Q9Y239 1/20 0.41
▸ SPHK1 Q9NYA1 3/20 0.40
▸ EPHX1 P07099 5/20 0.40
▸ S1PR2 O95136 2/20 0.39
▸ S1PR1 P21453 2/20 0.39
▸ S1PR3 Q99500 2/20 0.39
▸ S1PR5 Q9H228 1/20 0.39

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
SCHEMBL23514654 0.93 SIRT6 (0.42) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL16263587 0.87 SIRT6 (0.42) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL16263589 0.87 SIRT6 (0.45) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL27113032 0.86 SIRT6 (0.48) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20543106 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20542997 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20542740 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20542642 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20542644 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3
SCHEMBL20542683 0.85 SIRT6 (0.56) DPP7SIRT6SIRT1RRM1GNAI3

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-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SUPERTRANS MEDICAL LTD (IL) 2024-02-29 — — 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-20240066135-A1 DRUG CONJUGATES AND USES THEREOF SLC7A1, ABCB11, SLC1A5 DPP7 378/4885SIRT6 1704/4885SIRT1 3325/4885

“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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