SCHEMBL7435401

SCHEMBL7435401

Fc1ccc(N2CC(CCCCN3CCC4(CC3)OCc3ccccc34)c3ccccc32)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
GRIN1 Q05586 1/20 0.50
GRIN2B Q13224 1/20 0.50

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
SCHEMBL8687458 0.79 HTR7 (0.39) TMEM97SIGMAR1
SCHEMBL7433042 0.79 GRIN1 (0.56) GRIN1GRIN2B
SCHEMBL7435393 0.76 TMEM97 (0.49) TMEM97SIGMAR1GRIN1GRIN2B
SCHEMBL467160 0.76 GRIN1 (0.70) SIGMAR1GRIN1GRIN2B
SCHEMBL7434969 0.74 GRIN1 (0.53) GRIN1GRIN2B
SCHEMBL8010301 0.74 GRIN1 (0.68) GRIN1GRIN2B
SCHEMBL8010239 0.74 GRIN1 (0.68) GRIN1GRIN2B
SCHEMBL4232283 0.74 TMEM97 (0.56) TMEM97SIGMAR1GRIN1GRIN2B
SCHEMBL7433209 0.73 TMEM97 (0.48) TMEM97SIGMAR1GRIN1GRIN2B
SCHEMBL8012780 0.73 GRIN1 (0.66) SIGMAR1GRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002102387-A1 TREATMENT OF NEUROPATHIC PAIN H. LUNDBECK A/S (DK) 2002-12-27 WO disclosed
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
US-5807871-A PSYCHOLOGICAL DISORDERS, ALZHEIMER OR PARKINSON DISEASE H. LUNDBECK A/S (DK) 1998-09-15 US disclosed
EP-0593511-B1 PIPERIDINE DERIVATES HAVING ANXIOLYTIC EFFECT LUNDBECK & CO AS H (DK) 1998-09-02 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