SCHEMBL7402468

SCHEMBL7402468

O=C1Cc2cc(OCCN3CCC(Cc4ccccc4)CC3)ccc2N1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 6/20 0.65
▸ MAOA P21397 1/20 0.65
▸ KDM1A O60341 2/20 0.64
▸ GRIN1 Q05586 2/20 0.64
▸ TMEM97 Q5BJF2 2/20 0.61
▸ SIGMAR1 Q99720 2/20 0.61
▸ ACHE P22303 2/20 0.57
▸ SLC6A4 P31645 2/20 0.56
▸ SLC6A2 P23975 1/20 0.56
▸ DRD2 P14416 1/20 0.53

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
SCHEMBL7402784 0.90 MAOB (0.65) MAOBMAOAKDM1AGRIN1TMEM97
SCHEMBL11067221 0.86 MAOB (0.79) MAOBMAOAKDM1ATMEM97SIGMAR1
SCHEMBL11066624 0.85 MAOB (0.87) MAOBMAOATMEM97SIGMAR1SLC6A4
SCHEMBL19047988 0.84 KDM1A (0.63) MAOBMAOAKDM1ASLC6A4DRD2
SCHEMBL11070336 0.80 MAOA (0.93) MAOBMAOASLC6A4SLC6A2DRD2
SCHEMBL8543338 0.80 GRIN1 (0.64) GRIN1ACHEDRD2
SCHEMBL8549047 0.79 GRIN1 (0.63) MAOBMAOAGRIN1
SCHEMBL11066390 0.79 MAOA (1.00) MAOBMAOADRD2
SCHEMBL11062856 0.79 MAOA (1.00) MAOBMAOADRD2
SCHEMBL22065546 0.78 KDM1A (1.00) KDM1A

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
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