SCHEMBL9910134

SCHEMBL9910134

CC1CCN(c2ncc3ccccc3n2)CC1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 1/20 0.69
HRH4 Q9H3N8 1/20 0.69
HCRTR1 O43613 4/20 0.54
HCRTR2 O43614 4/20 0.54
TSHR P16473 2/20 0.53
LMNA P02545 2/20 0.50
KMT2A Q03164 2/20 0.50
TRPC3 Q13507 1/20 0.50
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ACHE P22303 2/20 0.48
MEN1 O00255 1/20 0.47
PKM P14618 1/20 0.47
PDE10A Q9Y233 5/20 0.47
OGA O60502 1/20 0.47

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
SCHEMBL820825 0.83 HTR3A (0.64) HTR3AHRH4HCRTR1HCRTR2PDE10A
SCHEMBL30824484 0.83 HTR3A (0.73) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL5508534 0.83 HTR3A (0.73) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL29648042 0.83 HTR3A (0.73) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL603314 0.82 HTR3A (1.00) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL3776403 0.81 HTR3A (0.71) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL31691646 0.81 HTR3A (0.71) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL3551319 0.80 HTR3A (0.69) HTR3AHRH4HCRTR1HCRTR2PDE10A
SCHEMBL6931564 0.79 HCRTR1 (0.62) HTR3AHRH4HCRTR1HCRTR2TSHR
SCHEMBL2420211 0.79 HTR3A (0.67) HTR3AHRH4HCRTR1HCRTR2SMN1; SMN2

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
WO-2012074980-A2 METHODS OF TREATING OR PREVENTING AUTOIMMUNE DISORDERS AND LIVER DISORDERS USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. (US) 2012-06-07 WO disclosed
WO-2010141696-A1 METHODS OF TREATING OR PREVENTING PSORIASIS, AND/OR ALZHEIMER'S DISEASE USING INDANE ACETIC ACID DERIVATIVES DARA BIOSCIENCES, INC. (US) 2010-12-09 WO disclosed