SCHEMBL7878467

SCHEMBL7878467

CCCCCCCCCCCC[C@H](N)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 2/20 0.69
▸ GRIK2 Q13002 2/20 0.69
▸ SLC1A2 P43004 2/20 0.66
▸ SLC1A1 P43005 2/20 0.66
▸ GSR P00390 1/20 0.61
▸ GPR84 Q9NQS5 3/20 0.59
▸ FFAR1 O14842 1/20 0.59
▸ MAPT P10636 1/20 0.57
▸ LCK P06239 1/20 0.57
▸ PPARD Q03181 1/20 0.57
▸ ZDHHC20 Q5W0Z9 1/20 0.57
▸ ZDHHC2 Q9UIJ5 1/20 0.57
▸ NOD1 Q9Y239 2/20 0.57
▸ SLC1A3 P43003 1/20 0.57
▸ NOS2 P35228 2/20 0.56
▸ DDAH1 O94760 1/20 0.56
▸ ARG2 P78540 4/20 0.55
▸ ARG1 P05089 3/20 0.55
▸ ACE2 Q9BYF1 1/20 0.53
▸ NOS3 P29474 1/20 0.53

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
SCHEMBL7889574 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL660684 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL3689310 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL1527353 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL1738925 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL23531056 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL5048329 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL1960915 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL7861411 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR
SCHEMBL10579474 1.00 GRIK1 (0.69) GRIK1GRIK2SLC1A2SLC1A1GSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716242-B2 β-hairpin peptidomimetics POLYPHOR AG (CH) 2014-05-06 — — US disclosed
US-20120283196-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2012-11-08 — — US disclosed
US-20120045393-A1 LHRH-II PEPTIDE ANALOGS BRACCO IMAGING SPA (IT) 2012-02-23 — — US disclosed
US-20120045393-A1 LHRH-II PEPTIDE ANALOGS BRACCO IMAGING SPA (IT) 2012-02-23 — — US disclosed
WO-2010107832-A1 LHRH-II PEPTIDE ANALOGS BRACCO IMAGING SPA (IT) 2010-09-23 — — 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 (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-20120283196-A1 BETA-HAIRPIN PEPTIDOMIMETICS CXCL12, CXCR4, CXCR1 GRIK1 4195/4885GRIK2 4575/4885SLC1A2 1854/4885
US-20120045393-A1 LHRH-II PEPTIDE ANALOGS LHCGR, GNRHR, FSHR GRIK1 1744/4885GRIK2 1251/4885SLC1A2 2539/4885

“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.

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