SCHEMBL6456084

SCHEMBL6456084

C=CCCc1ccc(C2CCC3CC(CCC=C)CCC3C2)cc1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31

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
SCHEMBL6456081 1.00 HTR2A (0.31) HTR2AHTR2C
SCHEMBL6456887 0.92
SCHEMBL6456891 0.92
SCHEMBL6453423 0.90 HRH3 (0.32)
SCHEMBL6453427 0.90 HRH3 (0.32)
SCHEMBL6458361 0.88 CCR2 (0.34) HTR2AHTR2C
SCHEMBL6458356 0.88 CCR2 (0.34) HTR2AHTR2C
SCHEMBL6459330 0.86
SCHEMBL6459326 0.86
SCHEMBL6455571 0.85 SLC6A3 (0.31)

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
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed