SCHEMBL9048441

SCHEMBL9048441

CCOC(OCC)C1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCc2ccccc2C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.51
PREP P48147 15/20 0.48
GHSR Q92847 1/20 0.37
CPT2 P23786 2/20 0.36
CPT1A P50416 2/20 0.36
UCHL1 P09936 1/20 0.36

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
SCHEMBL9048437 1.00 F2 (0.51) F2PREPGHSRCPT2CPT1A
SCHEMBL9050560 1.00 F2 (0.51) F2PREPGHSRCPT2CPT1A
SCHEMBL9050551 1.00 F2 (0.51) F2PREPGHSRCPT2CPT1A
SCHEMBL9050454 0.95 PREP (0.51) F2PREPCPT2CPT1A
SCHEMBL9050449 0.95 PREP (0.51) F2PREPCPT2CPT1A
SCHEMBL9049378 0.89 PREP (0.53) F2PREP
SCHEMBL9050605 0.89 PREP (0.53) F2PREP
SCHEMBL9049364 0.89 PREP (0.59) F2PREPUCHL1
SCHEMBL9050882 0.89 PREP (0.59) F2PREPUCHL1
SCHEMBL9049367 0.89 PREP (0.59) F2PREPUCHL1

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-0536399-B1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARM CO LTD (JP) 1996-01-24 EP disclosed
US-5407950-A Brain disorders, senile dementia ZERIA PHARMACEUTICAL CO., LTD. (JP) 1995-04-18 US disclosed
EP-0536399-A1 NOVEL ARYLALKANOYLAMINE DERIVATIVE AND DRUG CONTAINING THE SAME ZERIA PHARMACEUTICAL CO., LTD. (JP) 1993-04-14 EP disclosed