SCHEMBL9873596

SCHEMBL9873596

CN1CC=C(c2c[nH]c3ccc(C=CS(C)(=O)=O)cc23)CC1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.63

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
SCHEMBL9873581 1.00 SLC6A4 (0.63) SLC6A4
SCHEMBL7482999 0.91 SLC6A4 (0.61) SLC6A4
SCHEMBL7483003 0.91 SLC6A4 (0.61) SLC6A4
Hydrochloric Acid SCHEMBL7483189 0.89 SLC6A4 (0.59) SLC6A4
SCHEMBL4563600 0.89 SLC6A4 (0.59) SLC6A4
SCHEMBL4563598 0.89 SLC6A4 (0.59) SLC6A4
Hydrochloric Acid SCHEMBL7483178 0.89 SLC6A4 (0.59) SLC6A4
SCHEMBL7804263 0.84 SLC6A4 (0.71) SLC6A4
SCHEMBL8019124 0.79 SLC6A4 (0.81) SLC6A4
SCHEMBL7485080 0.78 SLC6A4 (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001135-A Indole derivatives GLAXO GROUP LIMITED (GB) 1991-03-19 US disclosed
EP-0382570-A1 Indole derivatives GLAXO GROUP LIMITED (GB) 1990-08-16 EP disclosed