SCHEMBL25564681

SCHEMBL25564681

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT6 Q8N6T7 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ GRIA1 P42261 1/20 0.39
▸ EPHX1 P07099 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ TGM2 P21980 1/20 0.36
▸ SIRT5 Q9NXA8 1/20 0.36
▸ FOLH1 Q04609 1/20 0.35
▸ NMT1 P30419 4/20 0.34
▸ NMT2 O60551 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ CXCR3 P49682 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 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
SCHEMBL21206343 0.86 SIRT1 (0.40) SIRT6SIRT1GRIA1POLBTGM2
SCHEMBL28670837 0.83 FOLH1 (0.50) POLBTGM2FOLH1SMN1; SMN2
SCHEMBL28670835 0.83 FOLH1 (0.50) POLBTGM2FOLH1SMN1; SMN2
SCHEMBL13671361 0.83 POLB (0.41) SIRT6SIRT1GRIA1EPHX1POLB
SCHEMBL18630501 0.80 POLB (0.41) EPHX1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL23770334 0.77 POLB (0.46) EPHX1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL22727309 0.76 SIRT6 (0.44) SIRT6SIRT1EPHX1TGM2SIRT5
SCHEMBL22026768 0.76 SIRT1 (0.41) SIRT6SIRT1EPHX1SIRT5FOLH1
SCHEMBL26840286 0.76 SIRT6 (0.44) SIRT6SIRT1EPHX1TGM2SIRT5
SCHEMBL16283873 0.75 NOD1 (0.47) SIRT6SIRT1GRIA1POLBSIRT5

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-20230165882-A1 COMPOUNDS AND METHODS FOR REDUCTION OF CANCER CELL BURDEN AND PROTECTION OF NORMAL HEMATOPOIESIS GLYCOMIMETICS, INC. (US) 2023-06-01 — — 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-20230165882-A1 COMPOUNDS AND METHODS FOR REDUCTION OF CANCER CELL BURDEN AND PROTECTION OF NORMAL HEMATOPOIESIS FLT3, SELE, SELL SIRT6 1190/4885SIRT1 533/4885GRIA1 2363/4885

“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.

Send feedback