SCHEMBL6455507

SCHEMBL6455507

CCCC1CCC2CC(CCc3ccc(OC)cc3)CCC2C1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.48
TAAR1 Q96RJ0 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
HRH3 Q9Y5N1 2/20 0.40
SLC18A2 Q05940 1/20 0.40

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
SCHEMBL6455499 1.00 MAOB (0.48) MAOBTAAR1SIGMAR1HRH3SLC18A2
SCHEMBL13226039 0.91 MAOB (0.53) MAOBTAAR1SIGMAR1HRH3
SCHEMBL10717190 0.91 MAOB (0.53) MAOBTAAR1SIGMAR1HRH3
SCHEMBL11061464 0.89 MAOB (0.57) MAOBTAAR1SIGMAR1HRH3
SCHEMBL11061470 0.89 MAOB (0.57) MAOBTAAR1SIGMAR1HRH3
SCHEMBL10479468 0.88 MAOB (0.56) MAOBTAAR1SIGMAR1HRH3
SCHEMBL10479465 0.88 MAOB (0.56) MAOBTAAR1SIGMAR1HRH3
SCHEMBL6460953 0.83 DAO (0.35) MAOB
SCHEMBL6455066 0.83 TSHR (0.41) MAOB
SCHEMBL6455063 0.83 TSHR (0.41) MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed