SCHEMBL29993160

SCHEMBL29993160

Cc1ccc(Sc2ccccc2CN(C)C)c(N)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 18/20 1.00
SLC6A2 P23975 17/20 1.00
SLC6A3 Q01959 11/20 1.00
TDP1 Q9NUW8 1/20 1.00

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
SCHEMBL1644204 1.00 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
Hydrochloric Acid SCHEMBL1230664 0.99 SLC6A4 (0.97) SLC6A4SLC6A2SLC6A3TDP1
Hydrochloric Acid SCHEMBL23092175 0.99 SLC6A4 (0.97) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL30543447 0.85 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL1645160 0.85 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL12728082 0.84 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL8533846 0.84 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL1645148 0.84 SLC6A4 (0.72) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL20574691 0.84 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1
SCHEMBL1643432 0.84 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3TDP1

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-20220252611-A1 METHODS FOR USING MASS SPECTROSCOPY IN MULTIPLEX TARGET EVALUATIONS EUROFINS CEREP (FR) 2022-08-11 US disclosed