SCHEMBL7352124

SCHEMBL7352124

OC(CCN1CC2=CC=CCC2C1)c1ccc(F)cc1Br

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.33
HTR1A P08908 1/20 0.30

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
SCHEMBL7352464 0.87 KCNH2 (0.33) KCNH2HTR1A
SCHEMBL7345110 0.85
SCHEMBL7345865 0.82 SIGMAR1 (0.44) HTR1A
SCHEMBL7352535 0.80
SCHEMBL7355952 0.78
SCHEMBL7352340 0.75 HTR1A (0.42) KCNH2HTR1A
SCHEMBL7346136 0.71 HTR1A (0.39) KCNH2HTR1A
SCHEMBL7351319 0.70
SCHEMBL7347489 0.69 HTR1A (0.38) KCNH2HTR1A
SCHEMBL7347075 0.68 P2RX7 (0.37) HTR1A

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
EP-0972764-A1 Aminoalcohols and aminoketones as CNS active agents Universita Degli Studi di Firenze (IT) 2000-01-19 EP claimed
EP-0972764-A1 Aminoalcohols and aminoketones as CNS active agents Universita Degli Studi di Firenze (IT) 2000-01-19 EP disclosed