SCHEMBL7404192

SCHEMBL7404192

COc1ccc(CC2CCN(CCOc3ccc(F)cc3)CC2)cc1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.62
SIGMAR1 Q99720 2/20 0.62
LTA4H P09960 2/20 0.61
OPRM1 P35372 1/20 0.60
SLC6A4 P31645 2/20 0.56
HTR1A P08908 1/20 0.56
HRH3 Q9Y5N1 1/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 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
Hydrochloric Acid SCHEMBL7403957 0.99 TMEM97 (0.61) TMEM97SIGMAR1LTA4HOPRM1SLC6A4
SCHEMBL7400101 0.94 TMEM97 (0.70) TMEM97SIGMAR1LTA4HSLC6A4HRH3
Hydrochloric Acid SCHEMBL7406556 0.92 TMEM97 (0.68) TMEM97SIGMAR1LTA4HSLC6A4HRH3
Hydrochloric Acid SCHEMBL7406601 0.89 TMEM97 (0.61) TMEM97SIGMAR1LTA4HOPRM1SLC6A4
SCHEMBL3926715 0.88 TMEM97 (0.62) TMEM97SIGMAR1LTA4HSLC6A4HRH3
SCHEMBL7397997 0.88 TMEM97 (0.62) TMEM97SIGMAR1LTA4HSLC6A4HRH3
SCHEMBL7400054 0.88 TMEM97 (0.62) TMEM97SIGMAR1LTA4HHRH3
SCHEMBL7406116 0.88 SIGMAR1 (0.62) TMEM97SIGMAR1LTA4HSLC6A4HTR1A
SCHEMBL7406504 0.88 SIGMAR1 (0.62) TMEM97SIGMAR1LTA4HSLC6A4HTR1A
SCHEMBL7404295 0.87 TMEM97 (0.82) TMEM97SIGMAR1LTA4HSLC6A4HTR1A

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