SCHEMBL8609904

SCHEMBL8609904

O=c1[nH]c2cc(-n3cccc3)c(C(F)(F)F)cc2[nH]c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 6/20 1.00
▸ GRIA2 P42262 6/20 1.00
▸ GRIA3 P42263 6/20 1.00
▸ GRIA4 P48058 6/20 1.00
▸ GRIK1 P39086 2/20 0.57
▸ GRIK2 Q13002 2/20 0.57
▸ GRIK3 Q13003 2/20 0.57
▸ GRIK4 Q16099 2/20 0.57
▸ GRIK5 Q16478 2/20 0.57

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
SCHEMBL8298560 0.87 GRIA1 (0.77) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8139118 0.80 GRIA1 (0.67) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8689719 0.80 GRIA1 (0.66) GRIA1GRIA2GRIA3GRIA4GRIK1
Hydrochloric Acid SCHEMBL8130913 0.78 GRIA1 (0.63) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8684653 0.78 GRIA1 (0.63) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7787756 0.78 GRIA1 (0.61) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7739865 0.77 GRIA1 (0.61) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL7972413 0.76 GRIA1 (1.00) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8607976 0.74 GRIA1 (0.59) GRIA1GRIA2GRIA3GRIA4GRIK1
SCHEMBL8608735 0.73 GRIA1 (0.56) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5852017-A 2,3(1H,4H)-quinoxalinediones BASF AKTIENGESELLSCHAFT (DE) 1998-12-22 — — US disclosed
EP-0572852-B1 Quinoxalin-2,3(1H,4H)-diones used as medicine BASF AG (DE) 1998-10-21 — — EP disclosed
US-5714489-A 2,3(1H,4H)quinoxalinedione BASF AKTIENGESELLSCHAFT (DE) 1998-02-03 — — US disclosed
EP-0572852-A1 Quinoxalin-2,3(1H,4H)-diones used as medicine BASF Aktiengesellschaft (DE) 1993-12-08 — — EP disclosed
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