SCHEMBL7980655

SCHEMBL7980655

CC(=O)NC1CCc2[nH]c3cc(OCCNCC(O)c4ccccc4)ccc3c2C1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 8/20 0.44
ADRB1 P08588 4/20 0.44
ALOX15 P16050 1/20 0.44
ADRA1A P35348 4/20 0.41

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
SCHEMBL7979296 0.89 ADRB3 (0.57) ADRB3ADRB1ADRA1A
SCHEMBL7983967 0.85 HTR1D (0.48) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7979401 0.85 ADRB3 (0.46) ADRB3ADRA1A
SCHEMBL11418263 0.82 MCHR1 (0.49)
SCHEMBL7977557 0.81 L3MBTL1 (0.47)
SCHEMBL7980659 0.81 HTR1D (0.36)
SCHEMBL7967383 0.81 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7980850 0.81 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7977145 0.81 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7980657 0.79 HTR1D (0.35)

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