SCHEMBL7983494

SCHEMBL7983494

COC(CNCCOc1ccc2c3c(sc2c1)CCCC3)c1ccc(O)c(NS(C)(=O)=O)c1

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 20/20 0.44
ADRB2 P07550 2/20 0.39
ADRB1 P08588 1/20 0.39

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
SCHEMBL7977135 0.91 ADRB3 (0.54) ADRB3
SCHEMBL7979186 0.91 ADRB3 (0.54) ADRB3
Hydrochloric Acid SCHEMBL7967505 0.90 ADRB3 (0.53) ADRB3ADRB2
Hydrochloric Acid SCHEMBL7967507 0.90 ADRB3 (0.53) ADRB3ADRB2
SCHEMBL6905902 0.85 ADRB3 (0.45) ADRB3ADRB2ADRB1
Hydrochloric Acid SCHEMBL7108158 0.84 ADRB3 (0.45) ADRB3ADRB2ADRB1
SCHEMBL7967240 0.83 ADRB3 (0.45) ADRB3ADRB2ADRB1
SCHEMBL7977245 0.83 ADRB3 (0.46) ADRB3ADRB2
SCHEMBL7981246 0.82 ADRB3 (0.48) ADRB3
SCHEMBL7977560 0.82 ADRB3 (0.45) ADRB3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172099-B1 CARBAZOLE, DIBENZOFURAN, OR DIBENZOTHIOPHENE DERIVATIVES; DIETETICS, ANTIDIABETIC AGENTS; ANTILIPEMICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-01-09 US claimed
EP-0997458-A1 NOVEL TRICYCLIC COMPOUNDS HAVING SATURATED RINGS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-05-03 EP claimed
US-6172099-B1 CARBAZOLE, DIBENZOFURAN, OR DIBENZOTHIOPHENE DERIVATIVES; DIETETICS, ANTIDIABETIC AGENTS; ANTILIPEMICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-01-09 US disclosed
EP-0997458-A1 NOVEL TRICYCLIC COMPOUNDS HAVING SATURATED RINGS AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 2000-05-03 EP disclosed