SCHEMBL8944547

SCHEMBL8944547

CCOC(=O)CC1CN(Cc2ccccc2)CCN1Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.56
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL29713943 1.00 SIGMAR1 (0.56) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL26024193 0.90 SIGMAR1 (0.54) SIGMAR1
SCHEMBL123695 0.88 SIGMAR1 (0.61) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL6963422 0.85 OPRD1 (0.55) SIGMAR1ALDH1A1POLB
SCHEMBL1907279 0.85 OPRD1 (0.55) SIGMAR1ALDH1A1POLB
SCHEMBL20752939 0.84 ALDH1A1 (0.47) SIGMAR1ALDH1A1
SCHEMBL2471861 0.84 SIGMAR1 (0.50) SIGMAR1LMNAALDH1A1
SCHEMBL26024178 0.83 RORC (0.51) SIGMAR1ALDH1A1POLBGAA
SCHEMBL25154604 0.83 SIGMAR1 (0.57) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL4283405 0.83 SIGMAR1 (0.57) SIGMAR1LMNAALDH1A1POLBGAA

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-0638568-B1 Substituted piperazines, their process of preparation and the pharmaceutical compositions containing them ADIR (FR) 1996-10-09 EP disclosed
US-5500426-A ADMINISTERED TO IMPROVE GLUCOSE TOLERANCE ADIR ET COMPAGNIE (FR) 1996-03-19 US disclosed
US-5492912-A IMPROVES GLUCOSE TOLERANCE ADIR ET COMPAGNIE (FR) 1996-02-20 US disclosed
EP-0638568-A1 Substituted piperazines, their process of preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-02-15 EP disclosed