SCHEMBL8416477

SCHEMBL8416477

COC(=O)NCCc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.65
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
METTL3 Q86U44 1/20 0.51
METTL14 Q9HCE5 1/20 0.51

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
Fumaric Acid SCHEMBL8418205 0.81 KCNH2 (0.62) KCNH2METTL3METTL14
SCHEMBL8415553 0.81 KCNH2 (0.62) KCNH2METTL3METTL14
Maleic Acid SCHEMBL8418202 0.81 KCNH2 (0.62) KCNH2METTL3METTL14
SCHEMBL8119266 0.80 KCNH2 (0.70) KCNH2METTL3METTL14
SCHEMBL11834266 0.78 KCNH2 (0.74) KCNH2
SCHEMBL8112807 0.77 KCNH2 (0.73) KCNH2
Maleic Acid SCHEMBL8418382 0.75 KCNH2 (0.64) KCNH2METTL3METTL14
Fumaric Acid SCHEMBL8418386 0.75 KCNH2 (0.64) KCNH2METTL3METTL14
SCHEMBL8415269 0.75 KCNH2 (0.59) KCNH2METTL3METTL14
Hydrochloric Acid SCHEMBL8416468 0.75 KCNH2 (0.72) KCNH2

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-0939077-A2 3-Substituted 1-arylindole compounds as 5-HT2 antagonists H. LUNDBECK A/S (DK) 1999-09-01 EP disclosed
EP-0734384-A1 3-SUBSTITUTED 1-ARYLINDOLE COMPOUNDS H. LUNDBECK A/S (DK) 1996-10-02 EP disclosed
WO-1995016684-A1 3-SUBSTITUTED 1-ARYLINDOLE COMPOUNDS H. LUNDBECK A/S (DK) 1995-06-22 WO disclosed