SCHEMBL5888869

SCHEMBL5888869

c1ccc(OCCN2CCC(c3ccccc3)CC2)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.64
TMEM97 Q5BJF2 2/20 0.64
HRH3 Q9Y5N1 3/20 0.64
KDM1A O60341 1/20 0.61
SLC18A3 Q16572 2/20 0.61
DRD2 P14416 1/20 0.61
LTA4H P09960 2/20 0.58
CARM1 Q86X55 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
S1PR1 P21453 1/20 0.56
HTR1A P08908 1/20 0.56
HTR7 P34969 1/20 0.56
MEN1 O00255 1/20 0.55
TP53 P04637 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
TSHR P16473 1/20 0.55
CYP2C19 P33261 1/20 0.55
KMT2A Q03164 1/20 0.55

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 SCHEMBL7409637 0.98 SIGMAR1 (0.62) SIGMAR1TMEM97HRH3KDM1ASLC18A3
SCHEMBL5888791 0.92 HRH3 (0.74) SIGMAR1TMEM97HRH3KDM1ASLC18A3
SCHEMBL5888867 0.91 HRH3 (0.68) SIGMAR1TMEM97HRH3MEN1TP53
SCHEMBL2988852 0.90 SLC18A3 (0.54) SIGMAR1TMEM97HRH3KDM1ASLC18A3
Hydrochloric Acid SCHEMBL8170711 0.89 MAOB (0.58) HRH3SLC18A3LTA4HS1PR1
SCHEMBL6159055 0.85 HRH3 (0.65) SIGMAR1TMEM97HRH3DRD2LTA4H
SCHEMBL6943925 0.83 TMEM97 (0.68) SIGMAR1TMEM97HRH3KDM1ALTA4H
SCHEMBL8109834 0.83 TMEM97 (0.68) SIGMAR1TMEM97HRH3KDM1ALTA4H
SCHEMBL9311044 0.83 DRD2 (0.66) SIGMAR1TMEM97HRH3KDM1ADRD2
SCHEMBL20652680 0.83 DRD2 (0.77) SIGMAR1TMEM97HRH3DRD2HTR1A

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 11 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-7019016-B2 Therapy of sensorineural hearing loss in a mammal by administering NR2B subunit selective N-methyl-D-aspartate (NMDA) NR2B subtype receptor antagonist PFIZER INC (US) 2006-03-28 US disclosed
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
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
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 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