SCHEMBL6558780

SCHEMBL6558780

CCCN(C1CCc2cc(N)ccc2C1)C(C)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.49
DRD3 P35462 14/20 0.48
DRD2 P14416 12/20 0.48
DRD4 P21917 2/20 0.40
GRIN2B Q13224 1/20 0.39

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
SCHEMBL8145781 0.80 DRD3 (0.41) HTR1ADRD3DRD2GRIN2B
SCHEMBL8145785 0.80 DRD3 (0.41) HTR1ADRD3DRD2GRIN2B
SCHEMBL6561256 0.78 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL30612408 0.78 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL28997283 0.76 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL30335277 0.76 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL28997280 0.76 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL28997284 0.76 DRD2 (0.67) HTR1ADRD3DRD2DRD4
SCHEMBL8886530 0.76 DRD2 (0.49) HTR1ADRD3DRD2
SCHEMBL7436227 0.74 HTR1D (0.56) HTR1ADRD3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1091946-B1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2004-03-17 EP disclosed
US-6291494-B1 2-aminothiazol-fused 2-aminoindans and 2-aminotetralins and their use ASTRAZENECA AB (SE) 2001-09-18 US disclosed
EP-1091946-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTRÖM, Hakan Vilhelm (NL) 2001-04-18 EP disclosed
WO-2000001680-A1 NEW 2-AMINOTHIAZOL-FUSED 2-AMINOINDANS AND 2-AMINOTETRALINS AND THEIR USE WIKSTROEM HAKAN VILHELM (NL) 2000-01-13 WO disclosed