SCHEMBL19138290

SCHEMBL19138290

C[C@@H](O)[C@H](NC(=O)C1CCCN1C(=O)O)C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 6/20 0.51
▸ CTSB P07858 1/20 0.50
▸ XIAP P98170 1/20 0.44
▸ F2 P00734 1/20 0.40
▸ ELANE P08246 4/20 0.38
▸ POLB P06746 1/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ ACE P12821 2/20 0.37
▸ REN P00797 1/20 0.37

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
SCHEMBL19138289 1.00 CAPN1 (0.51) CAPN1CTSBXIAPF2ELANE
SCHEMBL19138358 1.00 CAPN1 (0.51) CAPN1CTSBXIAPF2ELANE
SCHEMBL19138353 0.95 CAPN1 (0.57) CAPN1CTSBXIAPF2ELANE
SCHEMBL19138297 0.95 CAPN1 (0.57) CAPN1CTSBXIAPF2ELANE
SCHEMBL19138298 0.95 CAPN1 (0.57) CAPN1CTSBXIAPF2ELANE
SCHEMBL19138322 0.95 CAPN1 (0.57) CAPN1CTSBXIAPF2ELANE
SCHEMBL28478640 0.85 CAPN1 (0.53) CAPN1CTSBXIAPELANEOPRM1
SCHEMBL28478644 0.85 CAPN1 (0.53) CAPN1CTSBXIAPELANEOPRM1
SCHEMBL14672906 0.85 ELANE (0.41) CAPN1CTSBXIAPELANEPOLB
SCHEMBL19165111 0.84 CAPN1 (0.55) CAPN1CTSBXIAPF2ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3916003-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME Naurex, Inc. (US) 2021-12-01 — — EP disclosed
EP-3171941-B1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2021-03-24 — — EP disclosed
US-20180258139-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2018-09-13 — — US disclosed
US-9994614-B2 N-methyl-D-aspartate receptor modulators and methods of making and using same NAUREX, INC. (US) 2018-06-12 — — US disclosed
US-20170210779-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2017-07-27 — — 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 (2 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-20180258139-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME GRIN1, GRIN2A, GRIN3A CAPN1 607/4885CTSB 3811/4885XIAP 1851/4885
US-20170210779-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME GRIN1, GRIN2A, GRIN3A CAPN1 607/4885CTSB 3811/4885XIAP 1851/4885

“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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