SCHEMBL5505308

SCHEMBL5505308

C=CCN1CCC(c2cccc(Cl)c2Cl)CC1.CCN1CCC(c2cccc(Cl)c2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
DRD2 P14416 7/20 0.42
HTR1A P08908 2/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DRD1 P21728 2/20 0.39
DRD5 P21918 2/20 0.39
SLC6A4 P31645 1/20 0.39
DRD3 P35462 2/20 0.38
HTR6 P50406 2/20 0.38
HRH3 Q9Y5N1 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
GRM2 Q14416 1/20 0.38
ADRA1B P35368 1/20 0.37
IDO1 P14902 1/20 0.36

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
SCHEMBL3759932 0.93 ADRA2A (0.54) ADRA2AADRA2BADRA2CDRD2HTR1A
SCHEMBL3759931 0.89 DRD2 (0.48) DRD2HTR1AHTR2AHTR2CHTR2B
SCHEMBL5509179 0.88 ADRA2A (0.43) ADRA2AADRA2BADRA2CDRD2HTR1A
SCHEMBL5503809 0.88 RBP4 (0.46) ADRA2AADRA2BADRA2CDRD2DRD1
SCHEMBL5501921 0.84 ADRA2A (0.41) ADRA2AADRA2BADRA2CDRD2MEN1
SCHEMBL2783386 0.83 ADRA2A (0.48) ADRA2AADRA2BADRA2CDRD2HTR1A
SCHEMBL3764528 0.83 ADRA2A (0.48) ADRA2AADRA2BADRA2CDRD2HTR1A
SCHEMBL5503801 0.83 DRD2 (0.46) ADRA2AADRA2BADRA2CDRD2SLC6A4
SCHEMBL5506603 0.82 DRD2 (0.38) ADRA2AADRA2BADRA2CDRD2HTR1A
SCHEMBL5525445 0.82 DRD2 (0.38) ADRA2AADRA2BADRA2CDRD2HTR1A

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-1768958-A1 NEW DISUBSTITUTED PHENYLPIPERIDINES AS MODULATORS OF DOPAMINE AND SEROTONIN NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2007-04-04 EP claimed
WO-2005121088-A1 NEW DISUBSTITUTED PHENYLPIPERIDINES AS MODULATORS OF DOPAMINE AND SEROTONIN NEUROTRANSMISSION A. CARLSSON RESEARCH AB (SE) 2005-12-22 WO claimed