SCHEMBL6487029

SCHEMBL6487029

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

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
CTSL P07711 4/20 0.49
CTSS P25774 4/20 0.49
CTSB P07858 3/20 0.47
CTSK P43235 3/20 0.47
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
ELANE P08246 2/20 0.46
SYK P43405 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44
ECE1 P42892 1/20 0.44

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
SCHEMBL23455707 1.00 ATM (0.53) ATMCTSLCTSSCTSBCTSK
SCHEMBL17352430 1.00 ATM (0.53) ATMCTSLCTSSCTSBCTSK
SCHEMBL23455705 1.00 ATM (0.53) ATMCTSLCTSSCTSBCTSK
SCHEMBL15936982 0.92 ATM (0.52) ATMCTSLCTSSCTSBCTSK
SCHEMBL23392518 0.92 ATM (0.52) ATMCTSLCTSSCTSBCTSK
SCHEMBL17351827 0.92 ATM (0.52) ATMCTSLCTSSCTSBCTSK
SCHEMBL25693847 0.91 ATM (0.51) ATMCTSLCTSSCTSBCTSK
SCHEMBL15936991 0.89 ATM (0.49) ATMCTSLCTSSCTSBCTSK
SCHEMBL6475821 0.86 CTSL (0.48) ATMCTSLCTSSCTSBCTSK
SCHEMBL14070425 0.85 ATM (0.47) ATMCTSLCTSSCTSBCTSK

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220112239-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS INNOVIVA TRC HOLDINGS LLC 2022-04-14 US disclosed
EP-3916003-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME Naurex, Inc. (US) 2021-12-01 EP disclosed
EP-3171941-B1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2021-03-24 EP disclosed
US-20200199173-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS INNOVIVA TRC HOLDINGS LLC 2020-06-25 US disclosed
US-10273239-B2 Spiro-lactam NMDA receptor modulators and uses thereof APTINYX INC. (US) 2019-04-30 US disclosed
US-20190031715-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS NAUREX INC (US) 2019-01-31 US disclosed
US-20180258139-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2018-09-13 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-9994614-B2 N-methyl-D-aspartate receptor modulators and methods of making and using same NAUREX, INC. (US) 2018-06-12 US disclosed
US-20170210779-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME NAUREX INC (US) 2017-07-27 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
US-20150368253-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF TENACIA BIOTECHNOLOGY (HONG KONG) CO., LIMITED (HK) 2015-12-24 US disclosed
US-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 US disclosed
EP-1413580-A1 Furanone derivatives as inhibitors of Cathepsin S Medivir UK Ltd (GB) 2004-04-28 EP disclosed
EP-1178986-B1 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LTD (GB) 2004-02-25 EP disclosed
US-20030203900-A1 Cysteine protease inhibitors MEDIVIR UK LTD (GB) 2003-10-30 US disclosed
EP-1178986-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S Medivir UK Ltd (GB) 2002-02-13 EP disclosed
WO-2000069855-A2 FURANONE DERIVATIVES AS INHIBITORS OF CATHEPSIN S MEDIVIR UK LIMITED (GB) 2000-11-23 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 (10 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-20220112239-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS PEPD, VIP, IAPP ATM 2989/4885CTSL 46/4885CTSS 1177/4885
US-20150368253-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A ATM 2196/4885CTSL 3751/4885CTSS 4304/4885
US-20180258139-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME GRIN1, GRIN2A, GRIN3A ATM 3114/4885CTSL 3260/4885CTSS 3757/4885
US-20190031715-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS PEPD, VIP, IAPP ATM 2989/4885CTSL 46/4885CTSS 1177/4885
US-20050020588-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV ATM 2255/4885CTSL 11/4885CTSS 1/4885
US-10273239-B2 Spiro-lactam NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A ATM 2196/4885CTSL 3751/4885CTSS 4304/4885
US-20170210779-A1 N-METHYL-D-ASPARTATE RECEPTOR MODULATORS AND METHODS OF MAKING AND USING SAME GRIN1, GRIN2A, GRIN3A ATM 3114/4885CTSL 3260/4885CTSS 3757/4885
US-20180179217-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A ATM 2196/4885CTSL 3751/4885CTSS 4304/4885
US-20200199173-A1 PROCESS AND INTERMEDIATES FOR SYNTHESIS OF PEPTIDE COMPOUNDS PEPD, VIP, IAPP ATM 2989/4885CTSL 46/4885CTSS 1177/4885
US-20030203900-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV ATM 2255/4885CTSL 11/4885CTSS 1/4885

“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.