SCHEMBL7983718

SCHEMBL7983718

CS(=O)(=O)Nc1cccc([C@H](O)CNCCOc2ccc3c4c([nH]c3c2)CCCC4)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.65
ADRA1A P35348 11/20 0.65
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
DRD3 P35462 1/20 0.43

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
SCHEMBL7553370 1.00 ADRB3 (0.65) ADRB3ADRA1AADRB2ADRB1DRD2
SCHEMBL7977262 1.00 ADRB3 (0.65) ADRB3ADRA1AADRB2ADRB1DRD2
Hydrochloric Acid SCHEMBL7967565 0.99 ADRB3 (0.64) ADRB3ADRA1AADRB2ADRB1DRD2
Hydrochloric Acid SCHEMBL7977538 0.99 ADRB3 (0.64) ADRB3ADRA1AADRB2ADRB1DRD2
Hydrochloric Acid SCHEMBL7979078 0.99 ADRB3 (0.64) ADRB3ADRA1AADRB2ADRB1DRD2
SCHEMBL7977503 0.93 ADRB3 (0.60) ADRB3ADRA1A
SCHEMBL7977504 0.93 ADRB3 (0.60) ADRB3ADRA1A
SCHEMBL7977552 0.92 ADRB3 (0.56) ADRB3ADRA1A
SCHEMBL7980592 0.89 ADRB3 (0.52) ADRB3ADRA1AADRB2ADRB1
SCHEMBL7980931 0.88 ADRB3 (0.50) ADRB3ADRA1AADRB2

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