SCHEMBL7757639

SCHEMBL7757639

CCCCc1ccc2c(c1)C(CCN)CO2

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.53
HTR1A P08908 2/20 0.53
HTR1D P28221 1/20 0.53
TAAR1 Q96RJ0 1/20 0.38
SKP2 Q13309 1/20 0.38
HTR2A P28223 3/20 0.37
DRD2 P14416 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SPHK2 Q9NRA0 7/20 0.34
SPHK1 Q9NYA1 5/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL7752947 0.92 HTR1A (0.56) HTR2CHTR1AHTR1DTAAR1DRD2
SCHEMBL7752945 0.86 HTR1A (0.58) HTR2CHTR1AHTR1DTAAR1SLC6A2
SCHEMBL7757677 0.79 MTNR1A (0.54) HTR2CHTR1AHTR1D
SCHEMBL95790 0.77 HTR2C (0.61) HTR2CHTR1AHTR1DHTR2ASLC6A2
SCHEMBL8130244 0.73 HTR1A (0.57) HTR2CHTR1AHTR1DTAAR1
SCHEMBL172889 0.73 HTR1A (0.57) HTR2CHTR1AHTR1DHTR2ADRD2
SCHEMBL8521537 0.73 CTSD (0.41) HTR2CSKP2HTR2ADRD2SLC6A2
SCHEMBL8575802 0.73 CTSD (0.41) HTR2CSKP2HTR2ADRD2SLC6A2
SCHEMBL11867423 0.72 THRA (0.45) HTR2CSLC6A2SLC6A4SPHK2SPHK1
SCHEMBL7755582 0.71 MTNR1A (0.51) HTR2CHTR1AHTR1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721947-B1 Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-03-14 EP disclosed
US-5703121-A SLEEP DISORDERS ADIR ET COMPAGNIE (FR) 1997-12-30 US disclosed
EP-0721947-A1 Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-07-17 EP disclosed