SCHEMBL31369948

SCHEMBL31369948

NC(=O)c1ccc(C[C@H](N)C(=O)O)nc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP1A2 P05177 1/20 0.46
TPH1 P17752 2/20 0.45
HSD17B10 Q99714 2/20 0.44
SLC7A5 Q01650 3/20 0.43
PKM P14618 2/20 0.43
ALPI P09923 1/20 0.43
PTGS1 P23219 1/20 0.43
XIAP P98170 1/20 0.43
GRM5 P41594 1/20 0.41
KDM4E B2RXH2 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 2/20 0.41
USP2 O75604 2/20 0.40
RGS12 O14924 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX15 P16050 1/20 0.40
NFKB1 P19838 1/20 0.40
CASP1 P29466 1/20 0.40

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
SCHEMBL5283089 0.80 SLC7A5 (0.56) CYP1A2HSD17B10SLC7A5PKMALPI
SCHEMBL15360000 0.80 CYP1A2 (0.49) CYP1A2TPH1HSD17B10SLC7A5PKM
SCHEMBL7205029 0.80 SLC7A5 (0.56) CYP1A2HSD17B10SLC7A5PKMALPI
Hydrochloric Acid SCHEMBL20422673 0.79 SLC7A5 (0.54) CYP1A2HSD17B10SLC7A5PKMALPI
SCHEMBL12128833 0.79 CYP1A2 (0.47) CYP1A2TPH1HSD17B10SLC7A5PKM
Hydrochloric Acid SCHEMBL20422675 0.79 SLC7A5 (0.54) CYP1A2HSD17B10SLC7A5PKMALPI
SCHEMBL4208145 0.79 CYP1A2 (0.47) SMN1; SMN2CYP1A2TPH1HSD17B10SLC7A5
SCHEMBL13957329 0.79 CYP1A2 (0.47) CYP1A2TPH1HSD17B10SLC7A5PKM
Hydrochloric Acid SCHEMBL25217806 0.77 CYP1A2 (0.46) CYP1A2HSD17B10SLC7A5PKMALPI
SCHEMBL5565798 0.76 SLC7A5 (0.47) SMN1; SMN2CYP1A2TPH1HSD17B10SLC7A5

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 NNMT 4103/4885SMN1; SMN2 4155/4885CYP1A2 4562/4885

“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.