SCHEMBL17359171

SCHEMBL17359171

CC(O)C(NC(=O)CN1CC2(CCCN2C(=O)OC(C)(C)C)C1=O)c1ncno1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
JAK3 P52333 2/20 0.34
DDR1 Q08345 3/20 0.30
CDK4 P11802 1/20 0.30
TSHR P16473 1/20 0.30
NAMPT P43490 1/20 0.30

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
SCHEMBL17351832 1.00 GRIN2B (0.47) GRIN2BGRIN2CJAK3DDR1CDK4
SCHEMBL20130471 0.89 GRIN2B (0.37) GRIN2BGRIN2C
SCHEMBL15937215 0.88 GRIN2B (0.32) GRIN2BGRIN2C
SCHEMBL15937177 0.88 GRIN2B (0.32) GRIN2BGRIN2C
SCHEMBL17359172 0.87 JAK3 (0.33) GRIN2BGRIN2CJAK3
SCHEMBL15937172 0.87 JAK3 (0.33) GRIN2BGRIN2CJAK3
SCHEMBL17359176 0.86 GRIN2B (0.47) GRIN2BGRIN2CJAK3DDR1
SCHEMBL17351830 0.86 GRIN2B (0.47) GRIN2BGRIN2CJAK3DDR1
SCHEMBL17351861 0.86 GRIN2B (0.49) GRIN2BGRIN2CJAK3DDR1CDK4
SCHEMBL19129129 0.84 JAK3 (0.40) GRIN2BGRIN2CJAK3TSHRNAMPT

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
US-20180127430-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2018-05-10 US disclosed
US-9708335-B2 Spiro-lactam NMDA receptor modulators and uses thereof Apytinyx Inc. (US) 2017-07-18 US disclosed
US-9708335-B2 Spiro-lactam NMDA receptor modulators and uses thereof Apytinyx Inc. (US) 2017-07-18 US disclosed
US-20150368254-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2015-12-24 US disclosed
US-20150368254-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 (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-20180127430-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A GRIN2B 5/4885GRIN2C 4/4885JAK3 4606/4885
US-20150368254-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A GRIN2B 5/4885GRIN2C 4/4885JAK3 4606/4885

“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.