SCHEMBL21462404

SCHEMBL21462404

[O-][S+](Cc1csc(I)n1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 9/20 0.35
▸ NOS1 P29475 1/20 0.33

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
SCHEMBL17504082 0.82 SLC6A3 (0.54) SLC6A3
SCHEMBL21456818 0.78 SLC6A3 (0.55) SLC6A3NOS1
SCHEMBL17504066 0.78 SLC6A3 (0.55) SLC6A3NOS1
SCHEMBL21462611 0.77 SLC6A3 (0.32) SLC6A3
SCHEMBL17504071 0.76 SLC6A3 (0.39) SLC6A3
SCHEMBL17504081 0.73 SLC6A3 (0.49) SLC6A3
SCHEMBL21462406 0.71 SLC6A3 (0.40) SLC6A3
SCHEMBL6377492 0.71 NOS1 (0.43) NOS1
SCHEMBL17504058 0.71 POLB (0.39) SLC6A3
SCHEMBL21462387 0.71 SLC6A3 (0.37) SLC6A3

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
WO-2021259798-A1 ((((3-HALOPHENYL)(PHENYL)METHYL)SULFINYL)METHYL)THIOPHENE COMPOUNDS AND DIASTEREOMERIC FORMS THEREOF FOR USE IN IMPROVING COGNITIVE FUNCTIONS RED BULL GMBH (AT) 2021-12-30 — — WO disclosed
WO-2019197670-A1 (S)-ENANTIOMERIC FORM OF A HETEROCYCLIC COMPOUND HAVING MOTIVATION IMPROVING AND/OR REFERENCE MEMORY ENHANCING ACTIVITY RED BULL GMBH (AT) 2019-10-17 — — WO disclosed
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