SCHEMBL6209843

SCHEMBL6209843

Cc1nnc(-c2cc3c(OC[C@@H](O)CN4CCC(c5cc6ccccc6s5)CC4)cccc3o2)o1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 18/20 0.60
SLC6A4 P31645 5/20 0.60

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
Hydrochloric Acid SCHEMBL6798195 0.98 HTR1A (0.58) HTR1ASLC6A4
SCHEMBL14571568 0.90 HTR1A (0.62) HTR1ASLC6A4
SCHEMBL5584910 0.89 HTR1A (0.49) HTR1ASLC6A4
SCHEMBL5584449 0.87 HTR1A (0.48) HTR1ASLC6A4
SCHEMBL14571549 0.87 KCNH2 (0.47) HTR1A
SCHEMBL14571526 0.86 HTR1A (0.48) HTR1ASLC6A4
SCHEMBL5584477 0.86 HTR1A (0.48) HTR1ASLC6A4
Hydrochloric Acid SCHEMBL5584890 0.86 HTR1A (0.48) HTR1ASLC6A4
Bromide SCHEMBL5584832 0.85 KCNH2 (0.46) HTR1A
SCHEMBL5585228 0.85 HTR1A (0.51) HTR1ASLC6A4

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-1188747-B1 PHENOXYPROPYLAMINE COMPOUNDS MITSUBISHI PHARMA CORP (JP) 2005-09-07 EP disclosed
EP-1188747-A1 PHENOXYPROPYLAMINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2002-03-20 EP disclosed