SCHEMBL8539481

SCHEMBL8539481

CNC(=O)Oc1ccc(C2CCCN2CCN2CCCCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.42
OPRM1 P35372 3/20 0.41
OPRK1 P41145 3/20 0.41
HRH3 Q9Y5N1 1/20 0.40
KDM4E B2RXH2 3/20 0.39
OPRD1 P41143 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
CHRNA7 P36544 1/20 0.38

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
SCHEMBL8544287 0.91 HRH3 (0.45) ACHEOPRM1OPRK1HRH3KDM4E
SCHEMBL8544368 0.90 ACHE (0.40) ACHEOPRM1OPRK1KDM4EOPRD1
SCHEMBL8545468 0.88 LIPE (0.52) OPRM1OPRK1HRH3KDM4E
SCHEMBL8872401 0.88 LIPE (0.52) OPRM1OPRK1HRH3KDM4E
SCHEMBL8871221 0.85 MEN1 (0.47) HRH3KDM4EMAPTALDH1A1ALOX15
SCHEMBL8543205 0.84 LIPE (0.53) HRH3ALDH1A1
SCHEMBL8871798 0.81 KDM4E (0.45) HRH3KDM4EMAPTPOLBALDH1A1
SCHEMBL8871835 0.80 ALDH1A1 (0.51) HRH3MAPTPOLBALDH1A1
SCHEMBL8539650 0.79 ACHE (0.46) ACHEHRH3KDM4EPOLB
SCHEMBL8546135 0.74 ACHE (0.47) ACHEHRH3KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0671388-B1 (Pyrrolidinyl)phenyl carbamates and intermediate compounds, processes for their preparation and their use as medicaments HOECHST MARION ROUSSEL INC (US) 1998-06-10 EP disclosed
US-5591856-A CHEMICAL INTERMEDIATES, TREATMENT OF ALZHEIMER'S DISEASE HOECHST ROUSSEL PHARMACEUTICALS INC. (US) 1997-01-07 US disclosed
US-5554750-A TO RELIEVE MEMORY DYSFUNCTIONS; TREATMENT OF ALZHEMER*S HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1996-09-10 US disclosed
EP-0671388-A1 (Pyrrolidinyl)phenyl carbamates and intermediate compounds, processes for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1995-09-13 EP disclosed
US-5405845-A Administering to relieve memory dysfunction; treatment of Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-04-11 US disclosed
US-5338739-A Memory dysfunction relieving compounds HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-08-16 US disclosed