SCHEMBL21900280

SCHEMBL21900280

Cc1ccc(C(=O)O)cc1-c1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIA1 P42261 3/20 0.84
▸ GRIK1 P39086 2/20 0.84
▸ GRIA2 P42262 1/20 0.84
▸ GRIA3 P42263 1/20 0.84
▸ GRIA4 P48058 1/20 0.84
▸ GRIK2 Q13002 1/20 0.54
▸ GRIK3 Q13003 1/20 0.54
▸ CACNG8 Q8WXS5 2/20 0.50
▸ TNKS2 Q9H2K2 1/20 0.50
▸ SIRT2 Q8IXJ6 1/20 0.46
▸ SIRT1 Q96EB6 1/20 0.46
▸ BCL6 P41182 1/20 0.46
▸ BCOR Q6W2J9 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ THRB P10828 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ RARA P10276 1/20 0.43
▸ RXRA P19793 1/20 0.43
▸ MAPT P10636 4/20 0.43

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
SCHEMBL18190480 0.85 GRIA1 (0.62) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL18190764 0.83 GRIA1 (0.59) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL18190765 0.80 GRIA1 (0.57) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL1095502 0.79 SIRT2 (0.69) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL4603074 0.78 GRIK1 (0.62) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL18190720 0.78 GRIA1 (0.55) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL12322303 0.78 GRIA1 (0.58) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL13332899 0.75 GRIA1 (0.53) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL18190461 0.75 GRIA1 (0.68) GRIA1GRIK1GRIA2GRIA3GRIA4
SCHEMBL2744390 0.75 GRIK1 (0.59) GRIA1GRIK1GRIA2GRIA3GRIA4

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
EP-3288936-B1 BENZIMIDAZOLONE AND BENZOTHIAZOLONE COMPOUNDS AND THEIR USE AS AMPA RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-05-06 — — EP claimed
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