SCHEMBL6950989

SCHEMBL6950989

Fc1ccc2c(c1)CC(CC1CNC=N1)CC2

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.45
ADRA2A P08913 2/20 0.45
ADRA2B P18089 1/20 0.45
ADRA2C P18825 1/20 0.45
HTR2B P41595 4/20 0.36
HTR2A P28223 3/20 0.36
DRD2 P14416 3/20 0.36
DRD3 P35462 2/20 0.36
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
CYP19A1 P11511 2/20 0.34
HTR2C P28335 4/20 0.33
DRD1 P21728 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 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
Fumaric Acid SCHEMBL8092913 0.90 SLC6A4 (0.38) SLC6A4ADRA2AADRA2BADRA2CHTR2B
Fumaric Acid SCHEMBL8092908 0.90 SLC6A4 (0.38) SLC6A4ADRA2AADRA2BADRA2CHTR2B
SCHEMBL6949357 0.89 SLC6A4 (0.56) SLC6A4ADRA2AADRA2BADRA2CHTR2B
SCHEMBL6950361 0.82 CYP19A1 (0.46) ADRA2AHTR1ACYP19A1
SCHEMBL14404061 0.79 ADRA2A (0.36) SLC6A4ADRA2AADRA2BADRA2CHTR2B
SCHEMBL9635389 0.74 SLC6A4 (0.44) SLC6A4ADRA2AADRA2BADRA2CHTR2B
Fumaric Acid SCHEMBL8097408 0.73 CYP19A1 (0.38) ADRA2AHTR1ACYP19A1
Fumaric Acid SCHEMBL8097411 0.73 CYP19A1 (0.38) ADRA2AHTR1ACYP19A1
SCHEMBL6959118 0.73 SLC6A4 (0.38) SLC6A4ADRA2AADRA2BADRA2CHTR2B
SCHEMBL6960737 0.72 ADRA2A (0.33) SLC6A4ADRA2AADRA2BADRA2C

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