SCHEMBL7401035

SCHEMBL7401035

O=c1[nH]c2ccc(OCCN3CCC(Cc4ccc(Cl)cc4)CC3)cc2[nH]1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.60
DRD2 P14416 8/20 0.59
DRD1 P21728 1/20 0.58
MAOB P27338 2/20 0.50
TMEM97 Q5BJF2 1/20 0.50
SIGMAR1 Q99720 1/20 0.50
LTA4H P09960 1/20 0.49
ACHE P22303 1/20 0.48

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
SCHEMBL7404779 0.90 GRIN1 (0.60) GRIN1DRD2DRD1MAOBTMEM97
SCHEMBL7405785 0.90 DRD2 (0.58) GRIN1DRD2DRD1TMEM97SIGMAR1
SCHEMBL7401860 0.89 DRD2 (0.66) GRIN1DRD2DRD1MAOBTMEM97
SCHEMBL7405352 0.84 SLC6A2 (0.67) GRIN1DRD2MAOBTMEM97SIGMAR1
SCHEMBL7401033 0.80 SIGMAR1 (0.51) MAOBTMEM97SIGMAR1LTA4HACHE
SCHEMBL7403268 0.80 KDM4E (0.53) GRIN1DRD2TMEM97SIGMAR1
SCHEMBL7403112 0.79 SIGMAR1 (0.55) MAOBTMEM97SIGMAR1LTA4HACHE
SCHEMBL7402467 0.79 DRD2 (0.56) GRIN1DRD2DRD1MAOBTMEM97
SCHEMBL7403098 0.79 DRD2 (0.55) GRIN1DRD2DRD1TMEM97SIGMAR1
SCHEMBL7405516 0.79 DRD2 (0.66) GRIN1DRD2DRD1MAOBTMEM97

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