SCHEMBL6944862

SCHEMBL6944862

CN1[C@@H]2CCC[C@]1(O)CC2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL4541902 1.00 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL17274595 1.00 ALDH1A1 (0.31) ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL7301084 0.98
SCHEMBL6729329 0.95 ALDH1A1 (0.32) ALDH1A1L3MBTL1
SCHEMBL6726321 0.95 ALDH1A1 (0.32) ALDH1A1L3MBTL1
SCHEMBL27905008 0.89
Cycloheptanone SCHEMBL14739731 0.84 TRIM24 (0.35) ALDH1A1
SCHEMBL11846859 0.72 ALDH1A1 (0.35) ALDH1A1L3MBTL1
SCHEMBL5731681 0.70
SCHEMBL7305562 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0604354-B1 Antidepressant and antiparkinsonian compounds NEUROSEARCH AS (DK) 2003-01-15 EP disclosed
EP-0604352-B1 Aryl-substituted heterocyclic compounds NEUROSEARCH AS (DK) 2002-10-09 EP disclosed
EP-0604355-B1 Akyl Substituted heterocyclic compounds NEUROSEARCH AS (DK) 2000-08-09 EP disclosed
US-5554626-A TREATMENT OF PARKINSON*S DISEASE, DRUG ABUSE/DEPENDENCE; COANIE/AMPHETAMINE ADDICTION NEUROSEARCH A/S (DK) 1996-09-10 US disclosed
US-5444070-A TREATING A DISEASE OR DISORDER WHICH IS RESPONSIVE TO THE INHIBITION OF DOPAMINE REUPTAKE BY ADMINISTERING A TROPANE DERIVATIVE NEUROSEARCH A/S (DK) 1995-08-22 US disclosed
US-5374636-A Antidrug abuse, antidepressants, antiParkinson activity NEUROSEARCH A/S (DK) 1994-12-20 US disclosed
US-5369113-A Certain 2,3-diphenyl-2-(1,2,4-oxadiazol-5-yl)tropanes useful as dopamide reuptake inhibitors NEUROSEARCH A/S (DK) 1994-11-29 US disclosed
EP-0604355-A2 Akyl Substituted heterocyclic compounds NEUROSEARCH A/S (DK) 1994-06-29 EP disclosed
EP-0604352-A2 Aryl substituted heterocyclic compounds NEUROSEARCH A/S (DK) 1994-06-29 EP disclosed
EP-0604354-A2 Antidepressant and antiparkinsonian compounds NEUROSEARCH A/S (DK) 1994-06-29 EP disclosed