SCHEMBL24061949

SCHEMBL24061949

CCNC(CNC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ MAPT P10636 2/20 0.40
▸ FOLH1 Q04609 3/20 0.36
▸ NAALAD2 Q9Y3Q0 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ RIMKLA Q8IXN7 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MMP1 P03956 1/20 0.32

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
SCHEMBL23482805 0.80 FOLH1 (0.38) MAPTFOLH1NAALAD2ALDH1A1KMT2A
SCHEMBL23193782 0.78 FOLH1 (0.36) MAPTFOLH1NAALAD2ALDH1A1KMT2A
SCHEMBL19401581 0.77 MMP2 (0.43) MAPTFOLH1MMP2MMP9MMP8
SCHEMBL13947584 0.77 — —
SCHEMBL17715215 0.77 — —
SCHEMBL3367018 0.77 — —
SCHEMBL10475828 0.76 MEN1 (0.49) KMT2AMEN1
SCHEMBL10475827 0.76 MEN1 (0.49) KMT2AMEN1
SCHEMBL17616111 0.75 CA2 (0.38) MAPTFOLH1NAALAD2RIMKLASMN1; SMN2
SCHEMBL19401717 0.75 GNPAT (0.33) MAPTFOLH1NAALAD2RIMKLA

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-11186541-B2 Potent inhibitors of aspartate N-acetyl-transferase for the treatment of Canavan disease THE UNIVERSITY OF TOLEDO (US) 2021-11-30 — — 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-11186541-B2 Potent inhibitors of aspartate N-acetyl-transferase for the treatment of Canavan disease GOT1, ACAT1, GOT2 CYP2D6 4022/4885CYP2C19 4450/4885MAPT 738/4885

“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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