SCHEMBL7436649

SCHEMBL7436649

c1ccc2c(c1)COC21CCN(CCCCc2cn(-c3ccncc3)c3ccccc23)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.80
TMEM97 Q5BJF2 1/20 0.80

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
Oxalic Acid SCHEMBL8557007 0.95 SIGMAR1 (0.73) SIGMAR1TMEM97
Siramesine SCHEMBL2090079 0.89 TMEM97 (1.00) SIGMAR1TMEM97
Siramesine SCHEMBL29358736 0.89 TMEM97 (1.00) SIGMAR1TMEM97
Siramesine SCHEMBL7495013 0.88 TMEM97 (0.98) SIGMAR1TMEM97
Siramesine SCHEMBL29888883 0.88 TMEM97 (0.98) SIGMAR1TMEM97
Siramesine SCHEMBL6198062 0.88 TMEM97 (0.98) SIGMAR1TMEM97
Siramesine SCHEMBL6198150 0.88 TMEM97 (0.98) SIGMAR1TMEM97
SCHEMBL7435838 0.86 SIGMAR1 (0.76) SIGMAR1TMEM97
SCHEMBL8185883 0.86 SIGMAR1 (0.75) SIGMAR1TMEM97
SCHEMBL7438180 0.85 SIGMAR1 (0.71) SIGMAR1TMEM97

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
US-6207677-B1 ADMINISERING SIGMA RECEPTOR BINDING PIPERIDINE DERIVATIVE FOR TREATING ANXIETY, EPILEPSY, CONVULSION, MOVEMENT DISORDER, AMNESIA H. LUNDBECK A/S (DK) 2001-03-27 US disclosed
US-6031099-A Piperidine derivates having anxiolytic effect H. LUNDBECK A/S (DK) 2000-02-29 US disclosed
EP-0593511-B1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT LUNDBECK & CO AS H (DK) 1998-09-02 EP disclosed
EP-0853085-A1 Piperidine derivatives having anxiolytic effect H. LUNDBECK A/S (DK) 1998-07-15 EP disclosed
US-5665725-A Piperidine derivatives having anxiolytic effect Lundbeck, H. (DK) 1997-09-09 US disclosed
EP-0518805-A1 Piperidine derivatives H. LUNDBECK A/S (DK) 1992-12-16 EP disclosed