SCHEMBL15936992

SCHEMBL15936992

C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](NC(=O)OCc1ccccc1)c1nnco1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
TACR1 P25103 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
SYK P43405 1/20 0.40
CTSK P43235 3/20 0.40
CTSL P07711 3/20 0.39
CTSS P25774 3/20 0.39
CTSB P07858 2/20 0.39
ELANE P08246 1/20 0.39

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
SCHEMBL17359183 0.85 ATM (0.59) ATMTACR1CTSKCTSLCTSS
SCHEMBL19134487 0.84 ATM (0.58) ATMTACR1SMN1; SMN2CTSKCTSL
SCHEMBL17357789 0.81 ATM (0.52) ATMTACR1SMN1; SMN2MAPTSYK
SCHEMBL17352430 0.79 ATM (0.53) ATMSMN1; SMN2SYKCTSKCTSL
SCHEMBL6487029 0.79 ATM (0.53) ATMSMN1; SMN2SYKCTSKCTSL
SCHEMBL23455705 0.79 ATM (0.53) ATMSMN1; SMN2SYKCTSKCTSL
SCHEMBL23455707 0.79 ATM (0.53) ATMSMN1; SMN2SYKCTSKCTSL
SCHEMBL23392518 0.78 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL17351827 0.78 ATM (0.52) ATMSYKCTSKCTSLCTSS
SCHEMBL15936982 0.78 ATM (0.52) ATMSYKCTSKCTSLCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180215767-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. 2018-08-02 US disclosed
US-20180179218-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. 2018-06-28 US disclosed
US-9828384-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2017-11-28 US disclosed
US-9828384-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2017-11-28 US disclosed
US-20150368252-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2015-12-24 US disclosed
US-20150368252-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2015-12-24 US disclosed
WO-2014120784-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF NAUREX, INC. (US) 2014-08-07 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 (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-20180179218-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A ATM 2196/4885TACR1 41/4885SMN1; SMN2 913/4885
US-20180215767-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A ATM 2196/4885TACR1 41/4885SMN1; SMN2 913/4885
US-20150368252-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN2B ATM 2404/4885TACR1 137/4885SMN1; SMN2 38/4885

“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.