SCHEMBL17356201

SCHEMBL17356201

CC(O)C(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(Cc1ncccn1)C2=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
SCN9A Q15858 11/20 0.35
CYP3A4 P08684 7/20 0.35
CTSL P07711 3/20 0.34
CTSB P07858 1/20 0.34
CTSK P43235 1/20 0.34
SCN10A Q9Y5Y9 6/20 0.33
TSHR P16473 1/20 0.33
BACE1 P56817 1/20 0.33
TRPA1 O75762 1/20 0.32
HRH2 P25021 2/20 0.32
HRH1 P35367 2/20 0.32

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
SCHEMBL17352408 1.00 GRIN2B (0.41) GRIN2BGRIN2CSCN9ACYP3A4CTSL
SCHEMBL19501065 0.94 CTSL (0.41) GRIN2BGRIN2CSCN9ACYP3A4CTSL
SCHEMBL20293867 0.87 GRIN2B (0.33) GRIN2BGRIN2C
SCHEMBL17356197 0.87 GRIN2B (0.33) GRIN2BGRIN2C
SCHEMBL20293868 0.87 GRIN2B (0.33) GRIN2BGRIN2C
SCHEMBL17352405 0.87 GRIN2B (0.33) GRIN2BGRIN2C
SCHEMBL17352398 0.86 GRIN2B (0.33) GRIN2BGRIN2C
SCHEMBL17679130 0.85 GRIN2B (0.39) GRIN2BGRIN2CCTSLCTSBCTSK
SCHEMBL17356196 0.85 GRIN2B (0.39) GRIN2BGRIN2CCTSLCTSBCTSK
SCHEMBL17356194 0.83 GRIN2B (0.39) GRIN2BGRIN2CCTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273239-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2019-04-30 US disclosed
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-06-28 US disclosed
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-06-28 US disclosed
US-9758525-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2017-09-12 US disclosed
US-20150368253-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2015-12-24 US disclosed
US-20150368253-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2015-12-24 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 (3 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-20150368253-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A GRIN2B 5/4885GRIN2C 4/4885SCN9A 444/4885
US-10273239-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A GRIN2B 5/4885GRIN2C 4/4885SCN9A 444/4885
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A GRIN2B 5/4885GRIN2C 4/4885SCN9A 444/4885

“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.