SCHEMBL3182737

SCHEMBL3182737

O=C(O)C1C[C@H]2C[C@@H](COCc3nnn[nH]3)CC[C@H]2CN1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 2/20 0.53
GRIA2 P42262 2/20 0.53
GRIA3 P42263 2/20 0.53
GRIA4 P48058 2/20 0.53
GRIN2D O15399 1/20 0.51
GRIN3B O60391 1/20 0.51
GRIK1 P39086 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2A Q12879 1/20 0.51
GRIN2B Q13224 1/20 0.51
GRIN2C Q14957 1/20 0.51
GRIN3A Q8TCU5 1/20 0.51
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL13319977 1.00 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL6493867 1.00 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL1807296 1.00 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL1811917 1.00 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8252920 0.90 GRIA1 (0.42) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL2783303 0.85 GRIA2 (0.64) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL20553364 0.85 GRIA2 (0.64) GRIA1GRIA2GRIA3GRIA4GRIN2D
SCHEMBL8867563 0.85 GRIA2 (0.64) GRIA1GRIA2GRIA3GRIA4GRIN2D
Tezampanel Anhydrous SCHEMBL3688366 0.83 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4GRIN2D
Tezampanel Anhydrous SCHEMBL3227089 0.83 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4GRIN2D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067978-A1 Methods of treating disorders with Group I mGluR antagonists BROWN UNIVERSITY RESEARCH FOUNDATION (BURF) (US) 2004-04-08 US claimed
US-7648993-B2 Methods of treating disorders with Group I mGluR antagonists BROWN UNIVERSITY (US) 2010-01-19 US disclosed
US-20050171067-A1 Methods of treating disorders with group I mGluR antagonists BROWN UNIVERSITY (US) 2005-08-04 US disclosed
US-20040067978-A1 Methods of treating disorders with Group I mGluR antagonists BROWN UNIVERSITY RESEARCH FOUNDATION (BURF) (US) 2004-04-08 US 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 (2 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-20050171067-A1 Methods of treating disorders with group I mGluR antagonists GRM5, GRIK5, GRM2 GRIA1 15/4885GRIA2 18/4885GRIA3 14/4885
US-20040067978-A1 Methods of treating disorders with Group I mGluR antagonists GRM5, GRIK5, GRM2 GRIA1 15/4885GRIA2 18/4885GRIA3 14/4885

“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.