SCHEMBL8414917

SCHEMBL8414917

CC(N)C(O)c1ccc2[nH]cc(C3=CCN(C)CC3)c2c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.64

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
SCHEMBL4418308 0.81 SLC6A4 (0.61) SLC6A4
SCHEMBL7479356 0.79 SLC6A4 (0.76) SLC6A4
SCHEMBL5367487 0.79 SLC6A4 (0.76) SLC6A4
SCHEMBL7817199 0.79 SLC6A4 (0.61) SLC6A4
SCHEMBL13323539 0.79 SLC6A4 (1.00) SLC6A4
Ammonia Solution, Strong SCHEMBL1122493 0.78 SLC6A4 (0.74) SLC6A4
SCHEMBL4418311 0.77 SLC6A4 (0.59) SLC6A4
SCHEMBL4673448 0.77 SLC6A4 (1.00) SLC6A4
SCHEMBL1275594 0.77 SLC6A4 (1.00) SLC6A4
SCHEMBL3130981 0.77 SLC6A4 (1.00) SLC6A4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5863935-A SYNTHESIS OF INDOLE DERIVATIVES OF HETEROCYCLIC COMPOUNDS FOR TREATMENT OF HEADACHES AND MIGRAINES ZENECA LIMITED (GB) 1999-01-26 US disclosed