SCHEMBL7803605

SCHEMBL7803605

CN1CCC(c2cccc3ccc(OCc4cc(-c5ccccc5)cs4)cc23)CC1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.40
HTR1D P28221 4/20 0.40
HTR1B P28222 4/20 0.40
DRD2 P14416 1/20 0.39
SLC6A4 P31645 1/20 0.39
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC6A9 P48067 1/20 0.37
KCNH2 Q12809 1/20 0.37
CXCR1 P25024 1/20 0.37
HRH3 Q9Y5N1 6/20 0.35
DRD3 P35462 1/20 0.35
PRMT5 O14744 1/20 0.35
PPARA Q07869 1/20 0.34

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
SCHEMBL7812335 0.85 HTR1A (0.40) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL7803565 0.82 HTR1A (0.62) HTR1AHTR1DHTR1BDRD2USP2
SCHEMBL7812482 0.80 HTR1A (0.41) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL7803546 0.80 HTR1A (0.42) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL1387863 0.80 RAB9A (0.53) MAPTTSHRTDP1
SCHEMBL7803556 0.79 SLC6A9 (0.40) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL7816032 0.78 HTR1A (0.41) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL8188389 0.78 HTR1A (0.39) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL7813263 0.77 SLC6A9 (0.45) HTR1AHTR1DHTR1BDRD2SLC6A4
SCHEMBL7812186 0.75 SLC6A9 (0.47) HTR1AHTR1DHTR1BDRD2SLC6A4

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 6 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
CN-1064350-C Aryl and heteroaryl alkoxynaphtalene derivatives PFIZER (US) 2001-04-11 CN disclosed
US-6166020-A Aryl and heteroaryl alkoxynaphthalene derivatives PFIZER INC. (US) 2000-12-26 US disclosed
CN-1151729-A Aryl and heteroaryl alkoxynaphtalene derivatives PFIZER (US) 1997-06-11 CN 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