SCHEMBL5595494

SCHEMBL5595494

COc1ccc(CNCCCN2CCNCC2)cc1OC

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
POLB P06746 1/20 0.58
TP53 P04637 1/20 0.50
THRB P10828 1/20 0.50

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
SCHEMBL2446278 0.91 KDM4E (0.65) KDM4EPOLB
SCHEMBL5595516 0.83 CHRM2 (0.57) KDM4E
SCHEMBL13068843 0.82 SIGMAR1 (0.62)
SCHEMBL6625725 0.80 SIGMAR1 (0.63)
Hydrochloric Acid SCHEMBL1332052 0.79 SIGMAR1 (0.61)
SCHEMBL5604920 0.77 SLC6A4 (0.64)
SCHEMBL29756433 0.77 CYP1A2 (0.57) KDM4ETP53
SCHEMBL4324560 0.77 CYP1A2 (0.57) KDM4ETP53
SCHEMBL11841171 0.77 CYP1A2 (0.57) KDM4ETP53
SCHEMBL5595644 0.76 CYP3A4 (0.57)

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-1809288-A1 USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2007-07-25 EP disclosed
WO-2006051489-A1 USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2006-05-18 WO disclosed