SCHEMBL7813178

SCHEMBL7813178

CC(C)N1CCC(c2cccc3ccc(OCc4cc(-c5ccc(Cl)cc5)sn4)cc23)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.40
SLC6A9 P48067 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
HTR1B P28222 1/20 0.40
F10 P00742 9/20 0.36
HRH3 Q9Y5N1 1/20 0.33
DRD2 P14416 1/20 0.33
SLC6A4 P31645 1/20 0.33
SIGMAR1 Q99720 2/20 0.32
GHSR Q92847 1/20 0.32
F2 P00734 1/20 0.32
ALOX5AP P20292 1/20 0.32

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
SCHEMBL7812186 0.76 SLC6A9 (0.47) KCNH2SLC6A9KDM4EMEN1MAPT
SCHEMBL27372901 0.74 SLC6A9 (0.44) KCNH2SLC6A9KDM4EMEN1MAPT
SCHEMBL7813263 0.74 SLC6A9 (0.45) KCNH2SLC6A9KDM4EMEN1MAPT
SCHEMBL7803889 0.73 SLC6A9 (0.45) KCNH2SLC6A9KDM4EMEN1MAPT
SCHEMBL7812976 0.71 CA12 (0.46) KCNH2SLC6A9
SCHEMBL27408116 0.69 MAPK14 (0.36) F10HRH3DRD2SLC6A4F2
SCHEMBL7808562 0.68 HTR1A (0.61) KCNH2SLC6A9HTR1BDRD2
SCHEMBL7803556 0.67 SLC6A9 (0.40) KCNH2SLC6A9MEN1MAPTKMT2A
SCHEMBL8188389 0.66 HTR1A (0.39) KCNH2SLC6A9MAPTHTR1BDRD2
SCHEMBL7810698 0.66 DRD2 (0.39) KCNH2SLC6A9KDM4EMEN1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0767782-B1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER (US) 2001-10-31 EP disclosed
US-6166020-A Aryl and heteroaryl alkoxynaphthalene derivatives PFIZER INC. (US) 2000-12-26 US disclosed
EP-0767782-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1997-04-16 EP disclosed
WO-1996000720-A1 ARYL AND HETEROARYL ALKOXYNAPHTHALENE DERIVATIVES PFIZER INC. (US) 1996-01-11 WO disclosed