SCHEMBL20204710

SCHEMBL20204710

N[C@@H](Cc1ccccc1)C(=O)NCC=O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC15A1 P46059 1/20 0.57
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
MMP2 P08253 3/20 0.52
CTSC P53634 1/20 0.52
LTA4H P09960 1/20 0.50
BACE1 P56817 2/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47

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
SCHEMBL26199086 0.90 OPRD1 (0.53) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL21010316 0.86 SLC15A1 (0.64) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL3112297 0.86 ALPI (0.54) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL15590804 0.86 ALPI (0.54) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL23933886 0.84 ALPI (0.53) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL17844273 0.83 ALPI (0.68) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL27590236 0.82 SLC15A1 (0.58) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL28969894 0.82 SLC15A1 (0.58) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL8195275 0.81 ALPI (0.61) SLC15A1ALPIPKMPTGS1XIAP
SCHEMBL5594394 0.81 ALPI (0.61) SLC15A1ALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3953463-A1 STABILIZED GLYCOSIDE HYDROLASE VARIANTS Novozymes A/S (DK) 2022-02-16 EP disclosed
US-20190352341-A1 MODIFIED PEPTIDES AND THEIR USE FOR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS IMMUPHARMA FRANCE SA (FR) 2019-11-21 US disclosed
WO-2018097999-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-31 WO 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-20190352341-A1 MODIFIED PEPTIDES AND THEIR USE FOR TREATING SYSTEMIC LUPUS ERYTHEMATOSUS SSB, LNPEP, ENPP2 SLC15A1 2304/4885ALPI 4138/4885PKM 3496/4885

“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.