SCHEMBL6729329

SCHEMBL6729329

CN1[C@H]2CCC[C@]1(O)CCC2

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL6726321 1.00 ALDH1A1 (0.32) ALDH1A1L3MBTL1
SCHEMBL6944862 0.95 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL17274595 0.95 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL4541902 0.95 ALDH1A1 (0.31) ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7301084 0.93
SCHEMBL27905008 0.84
Cycloheptanone SCHEMBL14739731 0.80 TRIM24 (0.35) ALDH1A1
SCHEMBL19257758 0.72 SIGMAR1 (0.31)
SCHEMBL11846859 0.72 ALDH1A1 (0.35) ALDH1A1L3MBTL1
SCHEMBL7442843 0.70 MAPK1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6676925-B1 BINDING WITH 9-AZABICYCLO(3.3.1)NONANE DERIVATIVES DETECTIVELY LABELED FOR POSITRON OR SINGLE PHOTON EMISSION COMPUTED TOMOGRAPHY IMAGING WAKE FOREST UNIVERSITY 2004-01-13 US disclosed
EP-0888345-A4 SIGMA-2 RECEPTORS AS BIOMARKERS OF TUMOR CELL PROLIFERATION UNIV WAKE FOREST (US) 2001-06-27 EP disclosed
US-6113877-A ADMINISTERING 8-AZABICYCLO(3.2.1)OCTANE OR 9-AZABICYCLO(3.3.1)NONANE DERIVATIVES; DETERMINING BREAST CANCER THERAPY WAKE FOREST UNIVERSITY (US) 2000-09-05 US disclosed
EP-0888345-A1 SIGMA-2 RECEPTORS AS BIOMARKERS OF TUMOR CELL PROLIFERATION WAKE FOREST UNIVERSITY (US) 1999-01-07 EP disclosed
WO-1997034892-A1 SIGMA-2 RECEPTORS AS BIOMARKERS OF TUMOR CELL PROLIFERATION WAKE FOREST UNIVERSITY (US) 1997-09-25 WO disclosed