SCHEMBL7405257

SCHEMBL7405257

C[C@@H]1C(=O)N(C(=O)C2[C@@H](C)[C@H]2C)[C@H]2CCN(C(=O)[C@@H]3CCCN3C(=O)OCc3ccccc3)[C@H]12

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.55

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
SCHEMBL7407424 1.00 PREP (0.55) PREP
SCHEMBL7413278 0.92
SCHEMBL7406047 0.92
SCHEMBL7511367 0.91 ELANE (0.60)
SCHEMBL7511361 0.91 ELANE (0.60)
SCHEMBL7405101 0.88 PREP (0.54) PREP
SCHEMBL7401667 0.82 ELANE (0.58)
SCHEMBL7404559 0.78 PREP (0.58) PREP
SCHEMBL7410346 0.76 ELANE (0.58)
SCHEMBL20678314 0.75 PREP (0.71) PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973775-A1 PYROLOPYRROLONE DERIVATIVES GLAXO GROUP LIMITED (GB) 2000-01-26 EP disclosed
WO-1998043975-A1 PYROLOPYRROLONE DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-10-08 WO disclosed