SCHEMBL7592244

SCHEMBL7592244

N#CCC1(C[N+](=O)[O-])CCCC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL5391383 0.98 ALDH1A1 (0.31) ALDH1A1NPSR1
SCHEMBL7590911 0.98 ALDH1A1 (0.31) ALDH1A1NPSR1
SCHEMBL7597514 0.98 ALDH1A1 (0.31) ALDH1A1NPSR1
SCHEMBL7598382 0.91 ALDH1A1 (0.30) ALDH1A1NPSR1
SCHEMBL8344960 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL10723413 0.80 TSHR (0.32) ALDH1A1
SCHEMBL2154171 0.77 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2155471 0.74 ALDH1A1 (0.38) ALDH1A1
SCHEMBL27614990 0.72
SCHEMBL15160716 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663394-B1 Process for preparing 5-aminodihydropyrrole, intermediate thereof and process for preparing said intermediate SUMITOMO CHEMICAL CO (JP) 2002-11-13 EP disclosed
US-5498725-A Process for preparing 5-aminodihydropyrrole intermediate thereof and process for preparing said intermediate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-03-12 US disclosed
EP-0663394-A1 Process for preparing 5-aminodihydropyrrole, intermediate thereof and process for preparing said intermediate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-07-19 EP disclosed