SCHEMBL15323951

SCHEMBL15323951

NCCOc1ccc2c(c1)C(Cc1ccccc1Cl)C(N1CCCC1)CC2

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 15/20 0.51
KCNH2 Q12809 2/20 0.50
HRH3 Q9Y5N1 2/20 0.39
MAOB P27338 1/20 0.37
MCHR1 Q99705 1/20 0.37
SIGMAR1 Q99720 1/20 0.37

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
Hydrochloric Acid SCHEMBL3094665 0.99 SLC6A9 (0.51) SLC6A9KCNH2HRH3MAOBMCHR1
SCHEMBL3103994 0.86 SLC6A9 (0.48) SLC6A9KCNH2MCHR1SIGMAR1
SCHEMBL15323949 0.86 SLC6A9 (0.48) SLC6A9KCNH2SIGMAR1
SCHEMBL15324460 0.86 SLC6A9 (0.60) SLC6A9KCNH2MAOB
Hydrochloric Acid SCHEMBL3094658 0.85 SLC6A9 (0.47) SLC6A9KCNH2SIGMAR1
Hydrochloric Acid SCHEMBL3094651 0.85 SLC6A9 (0.59) SLC6A9KCNH2MAOB
SCHEMBL3105543 0.85 SLC6A9 (0.55) SLC6A9KCNH2SIGMAR1
SCHEMBL3105653 0.84 SLC6A9 (0.67) SLC6A9KCNH2SIGMAR1
Hydrochloric Acid SCHEMBL3099016 0.84 SLC6A9 (0.54) SLC6A9KCNH2SIGMAR1
SCHEMBL15323634 0.84 SLC6A9 (0.53) SLC6A9KCNH2HRH3

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-2396296-B1 AMINOTETRALINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBVIE DEUTSCHLAND (DE) 2016-05-25 EP claimed
US-9067871-B2 Aminotetraline derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2015-06-30 US claimed
US-8563617-B2 Aminotetraline derivatives, pharmaceutical compositions containing them, and their use in therapy AbbVie Deutschland GmbH & Co. KG (DE) 2013-10-22 US claimed