SCHEMBL11638679

SCHEMBL11638679

COc1ccc2c(c1)CN(C)CC2c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 19/20 1.00
SLC6A2 P23975 12/20 1.00
SLC6A3 Q01959 12/20 1.00
HRH3 Q9Y5N1 7/20 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
SCHEMBL5247762 0.92 SLC6A4 (0.85) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL4457606 0.90 SLC6A4 (0.81) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL4035754 0.89 SLC6A2 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL4463258 0.89 SLC6A4 (0.79) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL5244478 0.88 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL5248299 0.88 SLC6A4 (0.78) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL1120086 0.87 SLC6A4 (0.77) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL12633242 0.87 SLC6A4 (0.77) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL1120084 0.87 SLC6A4 (0.77) SLC6A4SLC6A2SLC6A3HRH3
SCHEMBL11799175 0.87 SLC6A4 (0.77) SLC6A4SLC6A2SLC6A3HRH3

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-4113869-A MOOD MODIFIERS, ANOREXIA AGENTS BEECHAM GROUP LIMITED (GB) 1978-09-12 US disclosed