SCHEMBL7405685

SCHEMBL7405685

CN(CCN1CCC(Cc2ccccc2)CC1)c1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 0.59
GRIN2A Q12879 4/20 0.59
GRIN2D O15399 3/20 0.59
GRIN3B O60391 3/20 0.59
ADRA1D P25100 3/20 0.59
ADRA1A P35348 3/20 0.59
ADRA1B P35368 3/20 0.59
GRIN1 Q05586 3/20 0.59
GRIN2C Q14957 3/20 0.59
GRIN3A Q8TCU5 3/20 0.59
OPRM1 P35372 4/20 0.58
CCR3 P51677 1/20 0.55
HRH3 Q9Y5N1 1/20 0.54

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 SCHEMBL7403851 0.99 GRIN2B (0.58) GRIN2BGRIN2AGRIN2DGRIN3BADRA1D
SCHEMBL7411295 0.91 OPRM1 (0.64) OPRM1CCR3HRH3
Hydrochloric Acid SCHEMBL7402387 0.90 OPRM1 (0.62) OPRM1CCR3HRH3
SCHEMBL5757906 0.83 KCNH2 (0.63) GRIN2BGRIN2AOPRM1CCR3HRH3
Pimetine SCHEMBL1816328 0.81 CCR3 (0.67) GRIN2BOPRM1CCR3HRH3
Pimetine SCHEMBL636750 0.80 CCR3 (0.65) GRIN2BOPRM1CCR3HRH3
Pimetine SCHEMBL30496149 0.80 CCR3 (0.65) GRIN2BOPRM1CCR3HRH3
SCHEMBL7407241 0.79 CCR3 (0.82) GRIN2BGRIN2AGRIN2DGRIN3BADRA1D
Hydrochloric Acid SCHEMBL7410288 0.78 CCR3 (0.80) GRIN2BGRIN2AGRIN2DGRIN3BADRA1D
SCHEMBL7404650 0.76 CCR3 (0.76) GRIN2BGRIN2AGRIN2DGRIN3BADRA1D

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