SCHEMBL7983967

SCHEMBL7983967

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

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 3/20 0.48
HTR1B P28222 3/20 0.48
EGFR P00533 1/20 0.48
IGF1R P08069 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
NR2E1 Q9Y466 1/20 0.47
ADRB3 P13945 12/20 0.45
ADRB1 P08588 4/20 0.45
ALOX15 P16050 1/20 0.45
ADRA1A P35348 4/20 0.41
HTR6 P50406 1/20 0.41
ALDH1A1 P00352 1/20 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
SCHEMBL7967383 0.85 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL7977145 0.85 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL7980850 0.85 ALOX15 (0.51) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL7980655 0.85 ADRB3 (0.44) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7983526 0.82 ADRB3 (0.49) ADRB3ADRA1A
SCHEMBL6905931 0.79 ALOX15 (0.54) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL6912318 0.79 ALOX15 (0.54) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL6912018 0.79 ALOX15 (0.54) ADRB3ADRB1ALOX15ADRA1AALDH1A1
SCHEMBL7977543 0.79 ADRB3 (0.46) ADRB3ADRB1ALOX15ADRA1A
SCHEMBL7983973 0.78 HTR1B (0.49) HTR1DHTR1BEGFRIGF1RFLT4

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