SCHEMBL19851207

SCHEMBL19851207

CC(C)CN1CCNC2(CCNC2=O)C1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.34
OTUD7B Q6GQQ9 1/20 0.34
CYP2D6 P10635 10/20 0.33
CYP3A4 P08684 8/20 0.33
CYP1A2 P05177 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
USP2 O75604 3/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 2/20 0.32
RORC P51449 1/20 0.30
ALOX15 P16050 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
SCHEMBL25876725 0.78 PIK3CD (0.40) PIK3CDCYP2D6CYP3A4CYP1A2SMN1; SMN2
SCHEMBL25876724 0.77 PIK3CD (0.33) PIK3CDCYP2D6CYP3A4CYP1A2SMN1; SMN2
SCHEMBL19852847 0.75 OTUD7B (0.44) PIK3CDOTUD7BCYP2D6CYP3A4CYP1A2
SCHEMBL19851165 0.74 OTUD7B (0.36) OTUD7B
SCHEMBL19851168 0.73 SIGMAR1 (0.46) CYP2D6CYP3A4TSHRCYP2C19ALDH1A1
SCHEMBL13703126 0.73 OTUD7B (0.45) PIK3CDOTUD7BCYP2D6CYP3A4SMN1; SMN2
SCHEMBL19851210 0.72 CHRNB2 (0.32) OTUD7B
SCHEMBL21104769 0.71
SCHEMBL10232766 0.70 CRBN (0.42) PIK3CDCYP2D6SMN1; SMN2
SCHEMBL19851170 0.70 HSD17B10 (0.35) OTUD7BCYP2D6CYP3A4USP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210851-A1 SPIRO-LACTAM COMPOUNDS AND METHODS OF TREATING VIRAL INFECTIONS USING THE SAME APTINYX INC (US) 2023-07-06 US disclosed
US-20230131402-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC (US) 2023-04-27 US disclosed
US-20230131402-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC (US) 2023-04-27 US disclosed
US-20220273629-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2022-09-01 US disclosed
US-11376250-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2022-07-05 US disclosed
US-20210322406-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2021-10-21 US disclosed
US-10918637-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2021-02-16 US disclosed
WO-2021021996-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR APTINYX INC. (US) 2021-02-04 WO disclosed
US-20190175588-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2019-06-13 US disclosed
WO-2018026782-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 (7 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-11376250-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A PIK3CD 1900/4885OTUD7B 3931/4885CYP2D6 671/4885
US-20190175588-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A PIK3CD 1900/4885OTUD7B 3931/4885CYP2D6 671/4885
US-20210322406-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A PIK3CD 1900/4885OTUD7B 3931/4885CYP2D6 671/4885
US-10918637-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A PIK3CD 1900/4885OTUD7B 3931/4885CYP2D6 671/4885
US-20230210851-A1 SPIRO-LACTAM COMPOUNDS AND METHODS OF TREATING VIRAL INFECTIONS USING THE SAME ACE, ACE2, PREP PIK3CD 4354/4885OTUD7B 702/4885CYP2D6 628/4885
US-20220273629-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH ELEVATED LEVELS OF ANTIBODIES THAT INTERACT WITH THE NMDA RECEPTOR GRIN2A, GRIN2B, GRIN1 PIK3CD 4557/4885OTUD7B 2072/4885CYP2D6 3390/4885
US-20230131402-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A PIK3CD 1900/4885OTUD7B 3931/4885CYP2D6 671/4885

“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.