SCHEMBL7478280

SCHEMBL7478280

CC[C@]1(CC(O)CC(F)(F)F)CSc2ccc(OC)cc2[C@H](c2ccccc2)N1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 19/20 0.35
NQO2 P16083 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 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
SCHEMBL7478273 1.00 SLC10A2 (0.35) SLC10A2NQO2MTNR1AMTNR1B
SCHEMBL8206173 0.93 SLC10A2 (0.35) SLC10A2
SCHEMBL7473804 0.88 SLC10A2 (0.42) SLC10A2
SCHEMBL7473807 0.88 SLC10A2 (0.42) SLC10A2
SCHEMBL7479121 0.87 SLC10A2 (0.36) SLC10A2
SCHEMBL7479400 0.86 SLC6A9 (0.33) SLC10A2NQO2MTNR1AMTNR1B
SCHEMBL7479396 0.86 SLC6A9 (0.33) SLC10A2NQO2MTNR1AMTNR1B
SCHEMBL7474830 0.85 SLC10A2 (0.32) SLC10A2
SCHEMBL7474825 0.85 SLC10A2 (0.32) SLC10A2
SCHEMBL8693323 0.84 SLC10A2 (0.37) SLC10A2

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
EP-0683774-B1 HYPOLIPIDAEMIC COMPOUNDS WELLCOME FOUND (GB) 2002-10-09 EP disclosed
US-5723458-A 1,4-BENZOTHIAZEPINES GLAXO WELLCOME INC. (US) 1998-03-03 US disclosed