SCHEMBL7980812

SCHEMBL7980812

CC[Si](CC)(CC)OC(CNCCOc1ccc2c3c([nH]c2c1)CCCC3)c1ccc(F)c(NS(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 13/20 0.39
ADRA1A P35348 8/20 0.39
LMNA P02545 4/20 0.38
MAPT P10636 4/20 0.38
TP53 P04637 3/20 0.38
DRD2 P14416 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL7980808 1.00 ADRB3 (0.39) ADRB3ADRA1ALMNAMAPTTP53
SCHEMBL7980970 0.91 ADRB3 (0.39) ADRB3ADRA1ALMNAMAPTTP53
SCHEMBL7980974 0.91 ADRB3 (0.39) ADRB3ADRA1ALMNAMAPTTP53
SCHEMBL7980847 0.91 DRD2 (0.41) ADRB3ADRA1ALMNAMAPTTP53
SCHEMBL7979197 0.88 ADRB3 (0.52) ADRB3ADRA1ALMNAMAPTTP53
SCHEMBL7250383 0.87 ADRB3 (0.43) ADRB3ADRA1A
SCHEMBL7250377 0.87 ADRB3 (0.43) ADRB3ADRA1A
SCHEMBL7111828 0.86 ADRB3 (0.42) ADRB3ADRA1ADRD2
SCHEMBL7111831 0.86 ADRB3 (0.42) ADRB3ADRA1ADRD2
SCHEMBL7113359 0.86 ADRB3 (0.42) ADRB3ADRA1ADRD2

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 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