SCHEMBL7401858

SCHEMBL7401858

O=C1N=c2ccc(OCCN3CCC(Cc4ccccc4)CC3)cc2=N1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.66
SIGMAR1 Q99720 2/20 0.66
MAOB P27338 10/20 0.63
ACHE P22303 4/20 0.61
SLC6A2 P23975 1/20 0.60
SLC6A4 P31645 1/20 0.60
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
BCHE P06276 1/20 0.55
MAOA P21397 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
SCHEMBL7405349 0.94 SLC6A2 (0.69) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7405343 0.93 TMEM97 (0.66) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7401033 0.89 SIGMAR1 (0.51) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7404776 0.89 TMEM97 (0.51) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7403021 0.89 TMEM97 (0.66) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7405513 0.89 TMEM97 (0.66) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7403569 0.81 MEN1 (0.58) TMEM97SIGMAR1MAOBMEN1KMT2A
SCHEMBL5888854 0.80 TMEM97 (1.00) TMEM97SIGMAR1MAOBSLC6A2SLC6A4
SCHEMBL7246877 0.80 KCNH2 (0.41) TMEM97SIGMAR1MAOBACHESLC6A2
SCHEMBL7403632 0.79 SLC6A2 (0.76) TMEM97SIGMAR1MAOBACHESLC6A2

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