SCHEMBL8823682

SCHEMBL8823682

CCCN(C1CC1)C1COc2cccc(OS(=O)(=O)C(F)(F)F)c2C1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.57
DRD3 P35462 3/20 0.57
HTR1D P28221 2/20 0.57
DRD4 P21917 1/20 0.49

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
SCHEMBL8823690 0.86 DRD2 (0.59) DRD2DRD3HTR1D
SCHEMBL8823833 0.86 DRD2 (0.59) DRD2DRD3HTR1D
SCHEMBL8823795 0.83 DRD2 (0.56) DRD2DRD3HTR1DDRD4
SCHEMBL7619425 0.80 DRD2 (0.48) DRD2DRD3HTR1DDRD4
SCHEMBL7619434 0.80 DRD2 (0.48) DRD2DRD3HTR1DDRD4
SCHEMBL7614366 0.80 DRD2 (0.48) DRD2DRD3HTR1DDRD4
SCHEMBL7614362 0.80 DRD2 (0.48) DRD2DRD3HTR1DDRD4
SCHEMBL7615010 0.79 DRD2 (0.47) DRD2DRD3HTR1DDRD4
SCHEMBL7614997 0.79 DRD2 (0.47) DRD2DRD3HTR1DDRD4
SCHEMBL840041 0.78 DRD2 (0.48) DRD2DRD3HTR1DDRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5656657-A Chroman derivatives ASTRA AKTIEBOLAG (SE) 1997-08-12 US disclosed
US-5656658-A Method for the treatment of anxiety ASTRA AKTIEBOLAG (SE) 1997-08-12 US disclosed
US-5650524-A Process for preparing (R)-3-amino-5-methoxychroman ASTRA AKTIEBOLAG (SE) 1997-07-22 US disclosed
US-5646309-A Intermediates in the synthesis of chroman derivatives ASTRA AKTIEBOLAG (SE) 1997-07-08 US disclosed
US-5641807-A Method for the treatment of depression ASTRA AKTIEBOLAG (SE) 1997-06-24 US disclosed
US-5639784-A ADMINISTERING 3-AMINO-5-CARBAMOYL-CHROMENES AND DERIVATIVES ASTRA AKTIEBOLAG (SE) 1997-06-17 US disclosed
US-5639772-A Chroman derivatives ASTRA AKTIEBOLAG (SE) 1997-06-17 US disclosed
US-5500425-A Chroman derivatives and a method of treating 5-HT mediated disorders AKTIEBOLAGET ASTRA (SE) 1996-03-19 US disclosed
US-5420151-A Chroman derivatives AKTIEBOLAGET ASTRA (SE) 1995-05-30 US disclosed