SCHEMBL7977481

SCHEMBL7977481

COC(CNCCOc1ccc2c3c([nH]c2c1)CCCC3)c1ccc(N)c(NS(C)(=O)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 13/20 0.40
ADRA1A P35348 8/20 0.40
TP53 P04637 7/20 0.37
MAPT P10636 7/20 0.37
LMNA P02545 6/20 0.37
THRB P10828 1/20 0.36
POLB P06746 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
SCHEMBL7967240 0.91 ADRB3 (0.45) ADRB3ADRA1A
SCHEMBL7977494 0.90 ADRB3 (0.49) ADRB3ADRA1A
SCHEMBL6914539 0.85 ADRB3 (0.44) ADRB3ADRA1A
Hydrochloric Acid SCHEMBL7110926 0.85 ADRB3 (0.43) ADRB3ADRA1A
SCHEMBL7980974 0.82 ADRB3 (0.39) ADRB3ADRA1ATP53MAPTLMNA
SCHEMBL7980812 0.82 ADRB3 (0.39) ADRB3ADRA1ATP53MAPTLMNA
SCHEMBL7980970 0.82 ADRB3 (0.39) ADRB3ADRA1ATP53MAPTLMNA
SCHEMBL7980847 0.82 DRD2 (0.41) ADRB3ADRA1ATP53MAPTLMNA
SCHEMBL7980808 0.82 ADRB3 (0.39) ADRB3ADRA1ATP53MAPTLMNA
SCHEMBL7600305 0.81 ADRB3 (0.54) ADRB3ADRA1A

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