SCHEMBL7967272

SCHEMBL7967272

CCN(CC)S(=O)(=O)Nc1cc([C@@H](O)CNCCOc2ccc3[nH]c4c(c3c2)CCCCC4)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 9/20 0.44
MAPT P10636 10/20 0.43
TP53 P04637 9/20 0.43
LMNA P02545 7/20 0.43
ADRA1A P35348 1/20 0.39
ALDH1A1 P00352 1/20 0.39
THRB P10828 1/20 0.39
ADRB2 P07550 1/20 0.39
CHRM3 P20309 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
SCHEMBL7967234 1.00 ADRB3 (0.44) ADRB3MAPTTP53LMNAADRA1A
SCHEMBL7977677 0.93 ADRB3 (0.44) ADRB3ADRA1AADRB2CHRM3
SCHEMBL7980816 0.93 ADRB3 (0.46) ADRB3MAPTTP53LMNATHRB
SCHEMBL7980814 0.93 ADRB3 (0.46) ADRB3MAPTTP53LMNATHRB
Hydrochloric Acid SCHEMBL7980621 0.92 ADRB3 (0.45) ADRB3MAPTTP53LMNATHRB
Hydrochloric Acid SCHEMBL7980619 0.92 ADRB3 (0.45) ADRB3MAPTTP53LMNATHRB
SCHEMBL7967135 0.91 ADRB3 (0.54) ADRB3ADRA1A
SCHEMBL7967379 0.91 ADRB3 (0.54) ADRB3ADRA1A
SCHEMBL7977531 0.91 ADRB3 (0.54) ADRB3ADRA1A
SCHEMBL7977272 0.86 ADRB3 (0.46) ADRB3ADRA1AADRB2CHRM3

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-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