SCHEMBL8308288

SCHEMBL8308288

O=C(O)CC(NC(=O)OCc1ccccc1)C(=O)Cn1nnnc1Cc1ccccc1-c1ncc[nH]1

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 20/20 0.44

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
Hydrochloric Acid SCHEMBL7695508 0.99 CASP1 (0.44) CASP1
SCHEMBL8308582 0.88 CASP1 (0.43) CASP1
SCHEMBL7682119 0.88 CASP1 (0.44) CASP1
Hydrochloric Acid SCHEMBL7696210 0.88 CASP1 (0.43) CASP1
SCHEMBL7677209 0.87 CASP1 (0.46) CASP1
Hydrochloric Acid SCHEMBL7695644 0.87 CASP1 (0.43) CASP1
Hydrochloric Acid SCHEMBL7693610 0.86 CASP1 (0.46) CASP1
SCHEMBL7678294 0.85 CASP1 (0.44) CASP1
Hydrochloric Acid SCHEMBL8171192 0.84 CASP1 (0.44) CASP1
SCHEMBL7681991 0.83 CASP1 (0.53) CASP1

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-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP claimed