SCHEMBL22086451

SCHEMBL22086451

C[C@@H](O)[C@@H](C(N)=O)N1CC2(CN(C(=O)OC(C)(C)C)[C@@]3(CN([C@H](C(N)=O)[C@@H](C)O)C3=O)C2)C1=O

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.70
GRIN2C Q14957 1/20 0.70

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
SCHEMBL19853349 1.00 GRIN2B (0.70) GRIN2BGRIN2C
SCHEMBL24634182 1.00 GRIN2B (0.70) GRIN2BGRIN2C
SCHEMBL24634183 0.93 GRIN2B (0.62) GRIN2BGRIN2C
SCHEMBL22087526 0.83 GRIN2B (0.50) GRIN2BGRIN2C
SCHEMBL19853333 0.83 GRIN2B (0.50) GRIN2BGRIN2C
SCHEMBL22086449 0.82 GRIN2B (0.49) GRIN2BGRIN2C
SCHEMBL19853350 0.82 GRIN2B (0.49) GRIN2BGRIN2C
Zelquistinel SCHEMBL15936939 0.82 GRIN2B (1.00) GRIN2BGRIN2C
Zelquistinel SCHEMBL24636775 0.82 GRIN2B (1.00) GRIN2BGRIN2C
Zelquistinel SCHEMBL19629083 0.82 GRIN2B (1.00) GRIN2BGRIN2C

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-11028095-B2 Spiro-lactam and bis-spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2021-06-08 US disclosed
US-20200181159-A1 SPIRO-LACTAM AND BIS-SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2020-06-11 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-20200181159-A1 SPIRO-LACTAM AND BIS-SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN2C GRIN2B 4/4885GRIN2C 3/4885
US-11028095-B2 Spiro-lactam and bis-spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN2C GRIN2B 4/4885GRIN2C 3/4885

“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.