SCHEMBL7453218

SCHEMBL7453218

[O-][s+]1nc2ccc(OCCN3CCC(Cc4ccccc4)CC3)cc2n1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TMEM97 Q5BJF2 2/20 0.63
▸ SIGMAR1 Q99720 2/20 0.63
▸ SLC6A2 P23975 1/20 0.58
▸ SLC6A4 P31645 1/20 0.58
▸ MAOB P27338 9/20 0.56
▸ ACHE P22303 3/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ HRH3 Q9Y5N1 1/20 0.50
▸ LTA4H P09960 1/20 0.49
▸ BCHE P06276 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
SCHEMBL7453214 0.79 TMEM97 (0.63) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL5888854 0.79 TMEM97 (1.00) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7403553 0.78 TMEM97 (0.60) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7401032 0.78 TMEM97 (0.60) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7446465 0.78 TMEM97 (0.62) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7402049 0.78 TMEM97 (0.72) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7403632 0.78 SLC6A2 (0.76) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7405343 0.76 TMEM97 (0.66) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7403021 0.76 TMEM97 (0.66) TMEM97SIGMAR1SLC6A2SLC6A4MAOB
SCHEMBL7405513 0.76 TMEM97 (0.66) TMEM97SIGMAR1SLC6A2SLC6A4MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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