SCHEMBL7399430

SCHEMBL7399430

CCOC(=O)Cc1cccc(OCCN2CCC(Cc3ccccc3)CC2)c1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.63
SIGMAR1 Q99720 2/20 0.63
MAOB P27338 12/20 0.61
KDM4E B2RXH2 2/20 0.60
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
LTA4H P09960 1/20 0.53
MAOA P21397 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
SCHEMBL7406544 0.92 MEN1 (0.53) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7406643 0.90 TMEM97 (0.60) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7401219 0.85 TMEM97 (0.68) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7406645 0.83 TMEM97 (0.59) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7406595 0.83 TMEM97 (0.64) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7402027 0.82 ALDH1A1 (0.62) KDM4EMEN1KMT2A
SCHEMBL7400946 0.81 SIGMAR1 (0.52) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7403499 0.80 TMEM97 (0.73) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7402782 0.80 TMEM97 (0.76) TMEM97SIGMAR1MAOB
SCHEMBL7403890 0.80 TMEM97 (0.76) TMEM97SIGMAR1MAOBMEN1KMT2A

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