SCHEMBL26399356

SCHEMBL26399356

CNC(=N)N(C)c1ccc(C[C@H](N)C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 5/20 0.51
▸ CYP3A4 P08684 3/20 0.51
▸ ALOX15 P16050 3/20 0.51
▸ PTGS1 P23219 3/20 0.51
▸ ALDH1A1 P00352 2/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ CHRM2 P08172 1/20 0.51
▸ ADRA2A P08913 1/20 0.51
▸ CHRM1 P11229 1/20 0.51
▸ ACHE P22303 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ SLC6A3 Q01959 1/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ THPO P40225 1/20 0.51

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
SCHEMBL8426231 0.84 HIF1A (0.55) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL29588290 0.79 SLC7A5 (0.62) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL599748 0.79 SLC7A5 (0.62) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL2779272 0.79 SLC7A5 (0.62) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL23516383 0.76 CYP3A4 (0.53) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL23516382 0.76 CYP3A4 (0.53) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL10052559 0.76 HIF1A (0.52) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL23516381 0.76 CYP3A4 (0.53) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL16577963 0.76 SLC7A5 (0.62) HIF1ACYP3A4ALOX15PTGS1ALDH1A1
SCHEMBL2310526 0.74 SLC7A5 (0.83) HIF1ACYP3A4ALOX15PTGS1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312479-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-10-05 — — US disclosed
US-20230312479-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-10-05 — — 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-20230312479-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP HIF1A 2225/4885CYP3A4 4395/4885ALOX15 4829/4885

“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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