SCHEMBL8539550

SCHEMBL8539550

COc1cccc(C2CCCN2CCc2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.62
HTR1A P08908 1/20 0.54
SLC6A4 P31645 1/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
SIGMAR1 Q99720 2/20 0.51
THRB P10828 1/20 0.51
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
DRD2 P14416 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
SCHEMBL8543954 0.88 KDM4E (0.64) HRH3KDM4EALDH1A1SIGMAR1THRB
SCHEMBL22170305 0.85 DRD2 (0.63) HRH3KDM4EALDH1A1THRBLMNA
SCHEMBL8537692 0.84 THRB (0.53) HRH3KDM4EALDH1A1THRBLMNA
SCHEMBL8539614 0.82 ACHE (0.52) HRH3HTR1AALDH1A1
SCHEMBL11938594 0.82 DRD2 (0.57) HRH3KDM4EALDH1A1THRBLMNA
SCHEMBL19275752 0.82 THRB (0.56) HRH3KDM4EALDH1A1THRBLMNA
SCHEMBL8542265 0.81 OPRM1 (0.59) SIGMAR1
SCHEMBL8871760 0.81 DRD2 (0.50) HRH3KDM4EALDH1A1THRBLMNA
SCHEMBL10401257 0.81 SIGMAR1 (0.48) KDM4EALDH1A1SIGMAR1THRBLMNA
Hydrochloric Acid SCHEMBL10352120 0.80 DRD2 (0.57) HRH3KDM4EALDH1A1THRBLMNA

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