SCHEMBL7983419

SCHEMBL7983419

OC(CNCCOc1ccc2c3c(oc2c1)CCCC3)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.52
ADRB3 P13945 5/20 0.44
ADRB1 P08588 4/20 0.44
MAOB P27338 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
ACHE P22303 2/20 0.44
BCHE P06276 1/20 0.44
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL7978980 0.85 ADRB3 (0.62) ADRB3ADRB1
SCHEMBL7967611 0.85 ADRB3 (0.62) ADRB3ADRB1
SCHEMBL6906576 0.84 ALOX15 (0.54) ALOX15ADRB3ADRB1KMT2AKDM4E
Hydrochloric Acid SCHEMBL7108156 0.83 ALOX15 (0.56) ALOX15ADRB3ADRB1KMT2AALDH1A1
SCHEMBL7981096 0.81 ADRB3 (0.45) ADRB3MAOBTDP1
SCHEMBL7981099 0.81 ADRB3 (0.45) ADRB3MAOBTDP1
SCHEMBL7967383 0.80 ALOX15 (0.51) ALOX15ADRB3ADRB1ALDH1A1
SCHEMBL7980850 0.80 ALOX15 (0.51) ALOX15ADRB3ADRB1ALDH1A1
SCHEMBL7977145 0.80 ALOX15 (0.51) ALOX15ADRB3ADRB1ALDH1A1
SCHEMBL7980858 0.80 ADRB3 (0.55) ADRB3

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