SCHEMBL7345593

SCHEMBL7345593

CCC1=C(c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)CNC1=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.47
▸ GRIA1 P42261 1/20 0.47
▸ GRIA2 P42262 1/20 0.47
▸ GRIA3 P42263 1/20 0.47
▸ GRIA4 P48058 1/20 0.47
▸ GRIK2 Q13002 1/20 0.47
▸ GRIK3 Q13003 1/20 0.47
▸ GRIK4 Q16099 1/20 0.47
▸ GRIK5 Q16478 1/20 0.47

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
SCHEMBL7344749 0.86 GRIK1 (0.49) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7340723 0.83 PDE3B (0.38) —
SCHEMBL7342402 0.82 KDM4E (0.52) —
SCHEMBL7342584 0.78 PDE3B (0.49) —
Hydrochloric Acid SCHEMBL7348587 0.77 PDE3B (0.48) —
SCHEMBL7345017 0.77 LMNA (0.44) —
SCHEMBL10066486 0.75 GRIK1 (0.52) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL995544 0.73 GRIK1 (0.56) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL10786918 0.70 GRIK1 (0.57) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL7350046 0.69 ALDH1A1 (0.55) —

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
EP-0329691-B1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1991-11-21 — — EP disclosed
EP-0329691-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES. SCHERING AG (DE) 1989-08-30 — — EP disclosed
WO-1988003531-A1 CARDIOTONIC IMIDAZOLYLPHENYLPYRROL-2-ONES SCHERING AKTIENGESELLSCHAFT (DE) 1988-05-19 — — WO disclosed
US-4737511-A Cardiotonic imidazolylphenylpyrrol-2-ones SCHERING A.G. (DE) 1988-04-12 — — US disclosed
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