SCHEMBL8713979

SCHEMBL8713979

CCCCN1[C@@H]2COC[C@H]1C[C@@H](NC(=O)c1nn(C(C)CC)c3c(O)cccc13)C2

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HTR3A P46098 8/20 0.52
▸ HTR4 Q13639 10/20 0.49

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
SCHEMBL8716596 1.00 HTR3A (0.52) HTR3AHTR4
SCHEMBL8713981 1.00 HTR3A (0.52) HTR3AHTR4
SCHEMBL8716600 1.00 HTR3A (0.52) HTR3AHTR4
SCHEMBL8713858 0.93 HTR4 (0.54) HTR3AHTR4
SCHEMBL8713853 0.93 HTR4 (0.54) HTR3AHTR4
SCHEMBL8717880 0.87 HTR4 (0.62) HTR3AHTR4
SCHEMBL8713864 0.87 HTR4 (0.62) HTR3AHTR4
SCHEMBL8717786 0.87 HTR4 (0.62) HTR3AHTR4
SCHEMBL8714715 0.87 HTR4 (0.62) HTR3AHTR4
SCHEMBL8714713 0.87 HTR4 (0.62) HTR3AHTR4

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-0708105-B1 5-HT4 receptor agonists NISSHIN FLOUR MILLING CO (JP) 1998-12-23 — — EP disclosed
EP-0708105-A1 5-HT4 receptor agonists NISSHIN FLOUR MILLING CO., LTD. (JP) 1996-04-24 — — EP disclosed
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