SCHEMBL333798

SCHEMBL333798

NC(=O)C1CN(C(=O)O)CCN1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
SCN9A Q15858 2/20 0.34
GRIN2D O15399 3/20 0.33
GRIN3B O60391 3/20 0.33
GRIN1 Q05586 3/20 0.33
GRIN2A Q12879 3/20 0.33
GRIN2B Q13224 3/20 0.33
GRIN2C Q14957 3/20 0.33
GRIN3A Q8TCU5 3/20 0.33
THRB P10828 2/20 0.33
ALOX15 P16050 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GLI1 P08151 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
FPR2 P25090 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31

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
SCHEMBL12491318 1.00 MAPT (0.37) MAPTSCN9AGRIN2DGRIN3BGRIN1
SCHEMBL7397131 0.86 SCN9A (0.34) MAPTSCN9AGRIN2DGRIN3BGRIN1
SCHEMBL3424276 0.84 MAPT (0.50) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4578041 0.84 MAPT (0.50) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13506359 0.84 MAPT (0.50) MAPTGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL15432263 0.83 CHRNB2 (0.38) MAPTSCN9AALOX15CYP1A2GLI1
SCHEMBL17560422 0.79 CHRNB2 (0.42) MAPTSCN9ACYP1A2FPR2CHRNB2
SCHEMBL23459089 0.78 GLI1 (0.36) MAPTSCN9AGRIN2DGRIN3BGRIN1
SCHEMBL27559880 0.78 CHRNB2 (0.33) MAPTCHRNB2CHRNA3CHRNA4CHRNB3
SCHEMBL28062436 0.77 MAPT (0.47) MAPTGRIN2DGRIN3BGRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3401314-B1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC (US) 2023-11-08 EP disclosed
US-10919850-B2 Covalent inhibitors of KRas G12C ARAXES PHARMA LLC (US) 2021-02-16 US disclosed
US-10273207-B2 Covalent inhibitors of kras G12C ARAXES PHARMA LLC (US) 2019-04-30 US disclosed
EP-3401314-A1 COVALENT INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2018-11-14 EP disclosed
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2018-06-14 US disclosed
US-9926267-B2 Covalent inhibitors of K-Ras G12C ARAXES PHARMA LLC (US) 2018-03-27 US disclosed
US-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C ARAXES PHARMA LLC 2016-06-09 US disclosed
EP-2970121-A1 COVALENT INHIBITORS OF KRAS G12C Araxes Pharma LLC (US) 2016-01-20 EP disclosed
US-9227978-B2 Covalent inhibitors of Kras G12C ARAXES PHARMA LLC (US) 2016-01-05 US disclosed
US-8981084-B2 Oxadiazole HDAC inhibitors TEMPERO PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
EP-1485365-B1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA NV (BE) 2008-05-14 EP disclosed
US-20080108601-A1 anticancer agents; catalytic hydrogenation VAN EMELEN KRISTOF 2008-05-08 US disclosed
US-20070142393-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE EMELEN KRISTOF V 2007-06-21 US disclosed
US-7205304-B2 medicine to inhibit proliferative conditions, such as cancer and psoriasis JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-17 US disclosed
CN-1882576-A Quinazoline derivatives ASTRAZENECA AB (SE) 2006-12-20 CN disclosed
CN-1642931-A Sulfonyl derivatives as novel histone deacetylase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-07-20 CN disclosed
US-20050113373-A1 medicine to inhibit proliferative conditions, such as cancer and psoriasis; detecting or identifying a histone deactylase (HDAC) in a biological sample JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-26 US disclosed
EP-1485365-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2004-12-15 EP disclosed
WO-2003076422-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE JANSSEN PHARMACEUTICA N.V. (BE) 2003-09-18 WO disclosed
WO-2003041711-A1 PIPERAZINE BIS-AMIDE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF THE OREXIN RECEPTOR SMITHKLINE BEECHAM P.L.C. (GB) 2003-05-22 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-20160159738-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS MAPT 4316/4885SCN9A 3351/4885GRIN2D 4188/4885
US-20050113373-A1 medicine to inhibit proliferative conditions, such as cancer and psoriasis; detecting or identifying a histone deactylase (HDAC) in a biological sample HDAC1, HDAC11, HDAC4 MAPT 1306/4885SCN9A 3372/4885GRIN2D 4357/4885
US-20180162812-A1 COVALENT INHIBITORS OF KRAS G12C KRAS, NRAS, HRAS MAPT 4316/4885SCN9A 3351/4885GRIN2D 4188/4885
US-10919850-B2 Covalent inhibitors of KRas G12C KRAS, NRAS, HRAS MAPT 4316/4885SCN9A 3351/4885GRIN2D 4188/4885
US-20070142393-A1 SULFONYL-DERIVATIVES AS NOVEL INHIBITORS OF HISTONE DEACETYLASE HDAC3, HDAC1, HDAC11 MAPT 4071/4885SCN9A 317/4885GRIN2D 1738/4885
US-20080108601-A1 anticancer agents; catalytic hydrogenation HDAC1, HDAC11, HDAC3 MAPT 3759/4885SCN9A 2236/4885GRIN2D 3917/4885
US-10273207-B2 Covalent inhibitors of kras G12C KRAS, NRAS, HRAS MAPT 4316/4885SCN9A 3351/4885GRIN2D 4188/4885

“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.