SCHEMBL25359079

SCHEMBL25359079

N[C@H](Cc1cccc(OCC(=O)O)c1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 6/20 0.56
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
GRIA2 P42262 1/20 0.54
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
LMNA P02545 1/20 0.53
NOS3 P29474 2/20 0.52
NOS1 P29475 2/20 0.52
NOS2 P35228 2/20 0.52
PTGDR2 Q9Y5Y4 1/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL25356665 1.00 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL25355736 1.00 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL31688532 0.90 NOS3 (0.55) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL7366640 0.85 SLC7A5 (0.60) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL31537556 0.85 SLC7A5 (0.58) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL2777704 0.85 SLC7A5 (0.58) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL10685032 0.85 SLC7A5 (0.60) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL2777702 0.85 SLC7A5 (0.58) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL6774239 0.84 SLC7A5 (0.57) SLC7A5ALPIPKMPTGS1XIAP
Hydrochloric Acid SCHEMBL6774240 0.84 SLC7A5 (0.57) SLC7A5ALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US claimed
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US disclosed
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 US disclosed
US-20230257343-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2023-08-17 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-20230257343-A1 NOVEL AMINO ACID DERIVATIVES DNPEP, BCAT1, ANPEP SLC7A5 21/4885ALPI 3748/4885PKM 3544/4885

“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.