SCHEMBL9870712

SCHEMBL9870712

CC1CN(C)CCN1CCOCCN1CCN(C)CC1C

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.35
SIGMAR1 Q99720 2/20 0.34

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
SCHEMBL29341763 0.86 GBA1 (0.39) DRD3SIGMAR1
SCHEMBL22360701 0.86 GBA1 (0.39) DRD3SIGMAR1
SCHEMBL27281638 0.78 GAA (0.33)
SCHEMBL18885236 0.78 GAA (0.33)
SCHEMBL29646200 0.78 GAA (0.33)
SCHEMBL18912360 0.76 SIGMAR1 (0.39) SIGMAR1
SCHEMBL12568602 0.76 SIGMAR1 (0.39) SIGMAR1
SCHEMBL81698 0.76 SIGMAR1 (0.39) SIGMAR1
SCHEMBL30598324 0.75 GBA2 (0.37) SIGMAR1
SCHEMBL30598291 0.75 GBA2 (0.37) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055581-A Dehydrochlorination reaction between n-alkyl substituted piperazine and bis(-chloroalkyl) ether; useful for urethane forming reaction SAN-APRO LIMITED (JP) 1991-10-08 US disclosed