SCHEMBL7300934

SCHEMBL7300934

CN1C2CCC1CC(NC(=O)Oc1c(O)c3sccc3[nH]c1=O)C2

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 3/20 0.41
HTR3E A5X5Y0 2/20 0.41
HTR3B O95264 2/20 0.41
HTR3D Q70Z44 2/20 0.41
HTR3C Q8WXA8 2/20 0.41
HTR4 Q13639 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL7300915 0.83 HTR3E (0.52) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7305858 0.75 HTR3E (0.48) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7305866 0.75 HTR3E (0.48) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7301719 0.69 HTR3E (0.51) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL9525624 0.67 HTR4 (0.48) HTR3AHTR4MEN1KMT2A
SCHEMBL7435902 0.67 KMT2A (0.72) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7308018 0.67 HTR3A (0.50) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7284925 0.66 MEN1 (0.46) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL9524435 0.65 SMN1; SMN2 (0.48) HTR4MEN1KMT2A
SCHEMBL7288748 0.65 HTR3A (0.48) HTR3AHTR3EHTR3BHTR3DHTR3C

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
EP-0503844-B1 Thienopyridine derivatives and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KK (JP) 1994-08-03 EP claimed