SCHEMBL7764899

SCHEMBL7764899

CN1CCC[C@@H]2Cc3c(cccc3OCBr)C[C@H]21

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 4/20 0.63
HTR1A P08908 13/20 0.51

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
SCHEMBL10762901 0.85 DRD2 (0.69) DRD2HTR1A
SCHEMBL10761978 0.85 DRD2 (0.69) DRD2HTR1A
SCHEMBL10762897 0.85 DRD2 (0.69) DRD2HTR1A
SCHEMBL10761973 0.85 DRD2 (0.69) DRD2HTR1A
SCHEMBL7772903 0.80 DRD2 (0.61) DRD2HTR1A
SCHEMBL7772893 0.80 DRD2 (0.61) DRD2HTR1A
SCHEMBL7772884 0.80 DRD2 (0.61) DRD2HTR1A
SCHEMBL10756314 0.78 DRD2 (1.00) DRD2HTR1A
SCHEMBL10756319 0.78 DRD2 (1.00) DRD2HTR1A
SCHEMBL10756310 0.78 DRD2 (1.00) DRD2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001036428-A1 SILYLATED HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2001-05-25 WO disclosed