SCHEMBL7980832

SCHEMBL7980832

O=[N+]([O-])c1cccc(C(O)CNCCOc2ccc3c4c([nH]c3c2)CCCC4)c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 18/20 0.44
ADRA1A P35348 11/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
GFER P55789 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALOX15 P16050 1/20 0.39
ADRB1 P08588 1/20 0.38

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
SCHEMBL7977543 0.86 ADRB3 (0.46) ADRB3ADRA1AALOX15ADRB1
SCHEMBL7983402 0.86 ADRB3 (0.38) ADRB3ADRA1AMEN1MAPTGFER
SCHEMBL7980850 0.86 ALOX15 (0.51) ADRB3ADRA1AALOX15ADRB1
SCHEMBL7967383 0.86 ALOX15 (0.51) ADRB3ADRA1AALOX15ADRB1
SCHEMBL7977145 0.86 ALOX15 (0.51) ADRB3ADRA1AALOX15ADRB1
SCHEMBL6915507 0.85 ADRB3 (0.47) ADRB3ADRA1AALOX15
SCHEMBL7980931 0.84 ADRB3 (0.50) ADRB3ADRA1AALOX15
SCHEMBL7983718 0.82 ADRB3 (0.65) ADRB3ADRA1AADRB1
SCHEMBL7977262 0.82 ADRB3 (0.65) ADRB3ADRA1AADRB1
SCHEMBL7553370 0.82 ADRB3 (0.65) ADRB3ADRA1AADRB1

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