SCHEMBL15324601

SCHEMBL15324601

CCNC1CCc2ccc(C(N)=O)cc2C1Cc1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 4/20 0.42
DRD2 P14416 2/20 0.42
SLC6A9 P48067 1/20 0.40
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
OPRK1 P41145 1/20 0.37
CCR3 P51677 1/20 0.37
NPY5R Q15761 1/20 0.36
SSTR3 P32745 3/20 0.35
TRPV1 Q8NER1 3/20 0.35
KCNH2 Q12809 2/20 0.35
MCHR1 Q99705 2/20 0.35
HTR2C P28335 1/20 0.35
MAOB P27338 1/20 0.34
PARP10 Q53GL7 1/20 0.34
ACHE P22303 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
Hydrochloric Acid SCHEMBL3105635 0.99 DRD3 (0.41) DRD3DRD2SLC6A9OPRM1OPRD1
SCHEMBL15323973 0.89 DRD3 (0.42) DRD3DRD2SLC6A9OPRM1OPRD1
Hydrochloric Acid SCHEMBL3108978 0.88 DRD3 (0.41) DRD3DRD2SLC6A9OPRM1OPRD1
SCHEMBL15324603 0.84 SLC6A9 (0.43) SLC6A9NPY5RTRPV1
Hydrochloric Acid SCHEMBL3105638 0.83 SLC6A9 (0.42) SLC6A9NPY5RTRPV1ACHE
SCHEMBL15324092 0.77 SLC6A9 (0.41) SLC6A9NPY5RTRPV1MCHR1
Hydrochloric Acid SCHEMBL3100983 0.76 SLC6A9 (0.40) SLC6A9NPY5RTRPV1MCHR1
SCHEMBL12475022 0.75 SLC6A9 (0.44) DRD3DRD2SLC6A9OPRM1OPRD1
Hydrochloric Acid SCHEMBL3111789 0.74 SLC6A9 (0.43) DRD3DRD2SLC6A9OPRM1OPRD1
SCHEMBL15323975 0.74 SLC6A9 (0.43) SLC6A9NPY5RTRPV1MAOB

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