SCHEMBL7409408

SCHEMBL7409408

c1ccc(CCCN2CCC(Cc3ccccc3)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.91
CCR3 P51677 2/20 0.91
HRH3 Q9Y5N1 1/20 0.81
KCNH2 Q12809 1/20 0.70
PRMT3 O60678 1/20 0.69
CARM1 Q86X55 1/20 0.69
PRMT6 Q96LA8 1/20 0.69
PRMT1 Q99873 1/20 0.69
PRMT8 Q9NR22 1/20 0.69
SLC6A2 P23975 1/20 0.68
SLC6A4 P31645 1/20 0.68
TMEM97 Q5BJF2 1/20 0.68
ABCB1 P08183 1/20 0.67

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 SCHEMBL7404260 0.98 SIGMAR1 (0.88) SIGMAR1CCR3HRH3KCNH2PRMT3
SCHEMBL7374609 0.95 SIGMAR1 (1.00) SIGMAR1CCR3HRH3KCNH2PRMT3
SCHEMBL8091672 0.94 SIGMAR1 (0.97) SIGMAR1CCR3HRH3KCNH2PRMT3
Hydrochloric Acid SCHEMBL7407431 0.94 SIGMAR1 (0.97) SIGMAR1CCR3HRH3KCNH2PRMT3
SCHEMBL7404650 0.91 CCR3 (0.76) SIGMAR1CCR3HRH3ABCB1
Hydrochloric Acid SCHEMBL7409767 0.90 CCR3 (0.74) SIGMAR1CCR3HRH3
SCHEMBL7403790 0.90 CCR3 (1.00) SIGMAR1CCR3HRH3PRMT3CARM1
SCHEMBL7405795 0.89 SIGMAR1 (0.72) SIGMAR1CCR3HRH3KCNH2SLC6A2
Hydrochloric Acid SCHEMBL7404097 0.88 CCR3 (0.97) SIGMAR1CCR3HRH3PRMT3CARM1
SCHEMBL7372248 0.87 CCR3 (0.84) SIGMAR1CCR3HRH3KCNH2

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