SCHEMBL7983797

SCHEMBL7983797

O=C1NC(=O)c2c(CCCN3CCc4ccccc4C3)cccc21

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 9/20 0.55
DRD3 P35462 5/20 0.55
HTR1A P08908 5/20 0.55
DRD2 P14416 3/20 0.47
HRH1 P35367 3/20 0.47
HTR2A P28223 2/20 0.47
SLC6A4 P31645 1/20 0.47
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL7983134 0.96 HTR7 (0.57) HTR7DRD3HTR1ADRD2HRH1
SCHEMBL8667745 0.81 WEE1 (0.40) HTR7DRD3HTR1ADRD2HRH1
SCHEMBL7986389 0.79 CCR3 (0.50)
SCHEMBL7986154 0.79 HTR1A (0.53) HTR7DRD3HTR1ADRD2
SCHEMBL8557009 0.78 CHEK1 (0.47) HTR2A
SCHEMBL3174237 0.78 CHEK1 (0.47) DRD3DRD2HRH1HTR2A
SCHEMBL7989675 0.77 SIGMAR1 (0.54) HTR7DRD2
SCHEMBL8554507 0.77 SIGMAR1 (0.47) HRH1HTR2A
SCHEMBL23142609 0.76 CCNE2 (0.43)
SCHEMBL4910767 0.76 CHEK1 (0.50) HTR1ADRD2

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
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed