SCHEMBL7980939

SCHEMBL7980939

O=C(NCCOc1ccc2[nH]c3c(c2c1)CCCCC3)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 6/20 0.47
TP53 P04637 2/20 0.47
KDM4E B2RXH2 6/20 0.47
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
MAPK1 P28482 1/20 0.46
HPGD P15428 1/20 0.46
CASP6 P55212 1/20 0.46
ALDH1A1 P00352 3/20 0.46
CASP1 P29466 1/20 0.45
TRPM8 Q7Z2W7 1/20 0.45
MAPKAPK2 P49137 1/20 0.45
GAA P10253 1/20 0.45
ALOX12 P18054 1/20 0.45
HTT P42858 1/20 0.45
ITGB3 P05106 1/20 0.44
ITGAV P06756 1/20 0.44

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
SCHEMBL7967629 0.91 MAPT (0.55) MAPTL3MBTL1LMNAKDM4EMEN1
SCHEMBL8316089 0.80 MAPKAPK2 (0.55) MAPTLMNATP53MEN1KMT2A
SCHEMBL8316102 0.78 MAPKAPK2 (0.55) MAPTLMNATP53TRPM8MAPKAPK2
SCHEMBL7110432 0.78 L3MBTL1 (0.60) MAPTL3MBTL1LMNAKDM4ESMN1; SMN2
SCHEMBL7979167 0.77 L3MBTL1 (0.56) MAPTL3MBTL1LMNAKDM4EMEN1
SCHEMBL7977236 0.76 L3MBTL1 (0.55) MAPTL3MBTL1LMNAMEN1KMT2A
SCHEMBL3264595 0.75 KMT2A (0.57) MAPTLMNATP53KDM4EMEN1
SCHEMBL7977557 0.75 L3MBTL1 (0.47) MAPTL3MBTL1LMNAMEN1KMT2A
SCHEMBL5197720 0.73 L3MBTL1 (0.59) MAPTL3MBTL1LMNAKDM4ESMN1; SMN2
SCHEMBL3811564 0.73 L3MBTL1 (0.80) MAPTL3MBTL1LMNASMN1; SMN2HPGD

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