SCHEMBL9216482

SCHEMBL9216482

N#CC(C#N)=C1NCCN1CCNCc1occc1CN1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
HRH3 Q9Y5N1 5/20 0.32
APP P05067 2/20 0.32

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
SCHEMBL9217113 0.94 L3MBTL1 (0.35) L3MBTL1HRH3APP
SCHEMBL9217119 0.81
SCHEMBL9218033 0.81 ACHE (0.47) HRH3
SCHEMBL9218017 0.81 ACHE (0.47) HRH3
SCHEMBL9217125 0.80 ACHE (0.46) HRH3
SCHEMBL9212413 0.79 HRH3 (0.33) HRH3APP
SCHEMBL9218339 0.79 APP (0.34) HRH3APP
SCHEMBL9216470 0.77 HRH3 (0.32) HRH3
Fumaric Acid SCHEMBL29754133 0.75 ACHE (0.44) HRH3
SCHEMBL9216873 0.75 CHRM2 (0.41)

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-0413343-B1 Furan derivatives KYOWA HAKKO KOGYO KK (JP) 1995-08-02 EP disclosed
US-5075301-A FURAN DERIVATIVES USEFUL FOR THE TREATMENT OF GASTRO-INTESTINAL DISORDERS KYOWA HAKKO KOGYO, CO., LTD. (JP) 1991-12-24 US disclosed
EP-0413343-A2 Furan derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-02-20 EP disclosed