SCHEMBL7406643

SCHEMBL7406643

CCOC(=O)CCc1cccc(OCCN2CCC(Cc3ccccc3)CC2)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 2/20 0.60
SIGMAR1 Q99720 2/20 0.60
MAOB P27338 7/20 0.59
KDM4E B2RXH2 3/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
NPSR1 Q6W5P4 1/20 0.56
LTA4H P09960 1/20 0.54
HTR1A P08908 1/20 0.52
SLC6A4 P31645 1/20 0.52
KCNH2 Q12809 2/20 0.52

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
SCHEMBL7399430 0.90 TMEM97 (0.63) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7406544 0.83 MEN1 (0.53) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7403499 0.82 TMEM97 (0.73) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL6005396 0.82 L3MBTL1 (0.62) KDM4ENPSR1KCNH2
SCHEMBL7406645 0.82 TMEM97 (0.59) TMEM97SIGMAR1MAOBKDM4EMEN1
SCHEMBL7247107 0.80 KCNH2 (0.61) TMEM97SIGMAR1KDM4EKCNH2
SCHEMBL7401219 0.80 TMEM97 (0.68) TMEM97SIGMAR1MAOBKDM4EMEN1
Bromide SCHEMBL7247104 0.79 KCNH2 (0.60) TMEM97SIGMAR1KDM4EKCNH2
SCHEMBL7403890 0.78 TMEM97 (0.76) TMEM97SIGMAR1MAOBMEN1KMT2A
SCHEMBL7402782 0.78 TMEM97 (0.76) TMEM97SIGMAR1MAOBHTR1ASLC6A4

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 3 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 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