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Sugi Predict / Compounds / SCHEMBL7976034

SCHEMBL7976034

SCHEMBL7976034

CCOC(=O)c1cccc(NC(=O)NCc2ccn(-c3cc4c(cc3C(F)(F)F)[nH]c(=O)c(=O)n4CC(=O)O)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 20/20 1.00
▸ GRIA2 P42262 20/20 1.00
▸ GRIA3 P42263 20/20 1.00
▸ GRIA4 P48058 20/20 1.00
▸ GRIK1 P39086 14/20 1.00
▸ GRIK2 Q13002 14/20 1.00
▸ GRIK3 Q13003 14/20 1.00
▸ GRIK4 Q16099 14/20 1.00
▸ GRIK5 Q16478 14/20 1.00

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
SCHEMBL7976407 0.93 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8672085 0.88 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7972520 0.84 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7972415 0.84 GRIA1 (0.85) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8674522 0.84 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL6608104 0.83 GRIA1 (0.71) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8675872 0.83 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8612054 0.82 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8609084 0.82 GRIA1 (0.81) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8686136 0.81 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277850-B1 EFFICIENCY, BIOCOMPATIBILITY, TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS ABBOTT LABORATORIES 2001-08-21 — — US disclosed