SCHEMBL7405352

SCHEMBL7405352

O=c1[nH]c2ccc(OCCCN3CCC(Cc4ccccc4)CC3)cc2[nH]1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.67
SLC6A4 P31645 1/20 0.67
TMEM97 Q5BJF2 2/20 0.65
SIGMAR1 Q99720 2/20 0.65
GRIN1 Q05586 2/20 0.61
ACHE P22303 3/20 0.61
BCHE P06276 1/20 0.61
MAOB P27338 8/20 0.60
DRD2 P14416 2/20 0.59
MAOA P21397 2/20 0.59
HRH3 Q9Y5N1 1/20 0.58

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
SCHEMBL7401860 0.95 DRD2 (0.66) SLC6A2SLC6A4TMEM97SIGMAR1GRIN1
SCHEMBL7404779 0.84 GRIN1 (0.60) TMEM97SIGMAR1GRIN1MAOBDRD2
SCHEMBL7401035 0.84 GRIN1 (0.60) TMEM97SIGMAR1GRIN1ACHEMAOB
SCHEMBL7405516 0.84 DRD2 (0.66) SLC6A2SLC6A4TMEM97SIGMAR1GRIN1
SCHEMBL7403024 0.84 TMEM97 (0.65) SLC6A2SLC6A4TMEM97SIGMAR1ACHE
SCHEMBL11064071 0.83 SLC6A2 (0.61) SLC6A2SLC6A4TMEM97SIGMAR1ACHE
SCHEMBL11066530 0.83 MAOB (0.62) SLC6A2SLC6A4TMEM97SIGMAR1ACHE
Hydrochloric Acid SCHEMBL11068549 0.82 SLC6A2 (0.60) SLC6A2SLC6A4TMEM97SIGMAR1ACHE
Hydrochloric Acid SCHEMBL11065081 0.81 MAOB (0.61) SLC6A2SLC6A4TMEM97SIGMAR1ACHE
SCHEMBL11218481 0.80 DRD2 (0.89) TMEM97SIGMAR1DRD2

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
EP-0869792-A4 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 1999-09-22 EP claimed
EP-0869792-A2 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-10-14 EP claimed
WO-1997023216-A1 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-07-03 WO claimed
US-6124323-A ACTIVE DRUG TREATING STROKE, CEREBRAL ISCHEMIA, CENTRAL NERVOUS SYSTEM TRAUMA, HYPOGLYCEMIA, ANXIETY, CONVULSIONS, AMIOGLYCOSIDE ANTIBIOTICS-INDUCED HEARING LOSS, MIGRAINE HEADACHES, CHRONIC PAIN, GLAUCOMA, CMV RETINITIS, PSYCHOSIS WARNER-LAMBERT COMPANY (US) 2000-09-26 US disclosed
EP-0869792-A4 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 1999-09-22 EP disclosed
EP-0869792-A2 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-10-14 EP disclosed
WO-1997023216-A1 4-SUBSTITUTED PIPERIDINE ANALOGS AND THEIR USE AS SUBTYPE SELECTIVE NMDA RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-07-03 WO disclosed