SCHEMBL7284925

SCHEMBL7284925

CN1C2CCC1CC(NC(=O)c1cnc3ccsc3c1O)C2

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HTR3A P46098 5/20 0.44
HTR3E A5X5Y0 4/20 0.44
HTR3B O95264 4/20 0.44
HTR3D Q70Z44 4/20 0.44
HTR3C Q8WXA8 4/20 0.44

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
SCHEMBL7286239 0.80 HTR3E (0.47) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL9199760 0.80 HTR3A (0.58) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7288976 0.80 HTR3A (0.44) MEN1KMT2AHTR3AHTR3EHTR3B
SCHEMBL7304555 0.80 HTR3A (0.44) MEN1KMT2AHTR3AHTR3EHTR3B
Pumosetrag SCHEMBL1497797 0.74 HTR3A (0.56) HTR3AHTR3EHTR3BHTR3DHTR3C
Pumosetrag SCHEMBL1497800 0.74 HTR3A (0.56) HTR3AHTR3EHTR3BHTR3DHTR3C
Pumosetrag SCHEMBL7287985 0.74 HTR3A (0.56) HTR3AHTR3EHTR3BHTR3DHTR3C
Pumosetrag SCHEMBL9432501 0.73 HTR3A (0.55) HTR3AHTR3EHTR3BHTR3DHTR3C
Pumosetrag SCHEMBL9432490 0.73 HTR3A (0.55) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL9429391 0.72 HTR3A (0.57) MEN1KMT2AHTR3AHTR3EHTR3B

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-0560348-B1 Thieno 3,2-b pyridine derivatives for the treatment of gastrointestinal disorders MITSUBISHI CHEM CORP (JP) 2002-07-10 EP disclosed
US-5352685-A Gastrointestinal disorders MITSUBISHI KASEI CORPORATION (JP) 1994-10-04 US disclosed
EP-0560348-A1 Thieno 3,2-b pyridine derivatives for the treatment of gastrointestinal disorders Mitsubishi Chemical Corporation (JP) 1993-09-15 EP disclosed