SCHEMBL6949362

SCHEMBL6949362

C1=N[C@H](CC2=Cc3ccccc3CC2)CN1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 3/20 0.56
HTR1A P08908 1/20 0.38
DRD2 P14416 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR7 P34969 1/20 0.38
HRH1 P35367 1/20 0.38
DRD3 P35462 1/20 0.38
HTR2B P41595 1/20 0.38
KDM1A O60341 1/20 0.35

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
SCHEMBL6958891 1.00 ADRA2A (0.56) ADRA2AHTR1ADRD2HTR2AHTR2C
SCHEMBL6949759 1.00 ADRA2A (0.56) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8091878 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8092398 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8091870 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8092403 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8085005 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
Fumaric Acid SCHEMBL8085007 0.89 ADRA2A (0.46) ADRA2AHTR1ADRD2HTR2AHTR2C
SCHEMBL6955357 0.87 ACHE (0.47) ADRA2AHTR1AHTR2AHTR7DRD3
SCHEMBL6960180 0.81 ADRA2A (0.37) ADRA2A

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-1010693-B1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-09-24 EP disclosed
EP-1010693-A1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-06-21 EP disclosed