SCHEMBL19852844

SCHEMBL19852844

CC(C)C(=O)N1CCCC12CCN(CC(N)=O)C2=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
BDKRB2 P30411 4/20 0.34
ENPP2 Q13822 1/20 0.32
DPP4 P27487 1/20 0.32
JAK3 P52333 1/20 0.31
APEX1 P27695 1/20 0.31
BLM P54132 1/20 0.31
HSD11B1 P28845 1/20 0.30
DRD2 P14416 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
SCHEMBL24338625 0.88 GRIN2B (0.38) TSHRGRIN2BGRIN2CBDKRB2DPP4
SCHEMBL26378804 0.88 GRIN2B (0.38) TSHRGRIN2BGRIN2CBDKRB2DPP4
SCHEMBL19852817 0.85 TSHR (0.41) TSHRGRIN2BGRIN2CBDKRB2APEX1
SCHEMBL19852896 0.85 TSHR (0.36) TSHRGRIN2BGRIN2CBDKRB2
SCHEMBL19852893 0.84 TSHR (0.35) TSHRGRIN2BGRIN2CBDKRB2
SCHEMBL24620374 0.84 GRIN2B (0.36) TSHRGRIN2BGRIN2CBDKRB2ENPP2
SCHEMBL24620375 0.83 DPP4 (0.37) TSHRGRIN2BGRIN2CBDKRB2DPP4
SCHEMBL19852941 0.83 TSHR (0.35) TSHRBDKRB2ENPP2APEX1BLM
SCHEMBL19852949 0.81 TSHR (0.40) TSHRGRIN2BGRIN2CBDKRB2ENPP2
SCHEMBL24338601 0.79 TSHR (0.38) TSHRBDKRB2ENPP2APEX1BLM

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-20230312591-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2023-10-05 US disclosed
US-20230312591-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2023-10-05 US disclosed
US-11530223-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2022-12-20 US disclosed
US-20220220119-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2022-07-14 US disclosed
US-11299495-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2022-04-12 US disclosed
WO-2018026779-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2018-02-08 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 (4 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-11299495-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A TSHR 1842/4885GRIN2B 5/4885GRIN2C 4/4885
US-11530223-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A TSHR 1842/4885GRIN2B 5/4885GRIN2C 4/4885
US-20220220119-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A TSHR 1842/4885GRIN2B 5/4885GRIN2C 4/4885
US-20230312591-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A TSHR 1842/4885GRIN2B 5/4885GRIN2C 4/4885

“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.