SCHEMBL7967052

SCHEMBL7967052

CNc1cc(C(O)CNCCOc2ccc3c4c([nH]c3c2)CCCC4)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 9/20 0.43
ADRB3 P13945 10/20 0.41
DRD2 P14416 2/20 0.40
DRD1 P21728 2/20 0.40
DRD4 P21917 2/20 0.40
DRD3 P35462 2/20 0.40
ADRB1 P08588 1/20 0.40
ADRA1A P35348 3/20 0.40

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
SCHEMBL7600308 0.90 ADRB3 (0.54) ADRB2ADRB3ADRA1A
SCHEMBL7979102 0.90 ADRB3 (0.54) ADRB2ADRB3ADRA1A
SCHEMBL7600305 0.90 ADRB3 (0.54) ADRB2ADRB3ADRA1A
SCHEMBL7983569 0.90 ADRB2 (0.56) ADRB2ADRB3DRD2DRD3ADRB1
Hydrochloric Acid SCHEMBL7979217 0.89 ADRB3 (0.54) ADRB2ADRB3ADRA1A
Hydrochloric Acid SCHEMBL7983471 0.89 ADRB3 (0.54) ADRB2ADRB3ADRA1A
Hydrochloric Acid SCHEMBL7979220 0.89 ADRB3 (0.54) ADRB2ADRB3ADRA1A
SCHEMBL7967289 0.88 ADRB2 (0.45) ADRB2ADRB3DRD2DRD1DRD4
SCHEMBL7977520 0.88 ADRB3 (0.48) ADRB2ADRB3ADRA1A
SCHEMBL7977666 0.88 ADRB2 (0.39) ADRB2ADRB3DRD2DRD1DRD4

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