SCHEMBL7980453

SCHEMBL7980453

CNS(=O)(=O)c1cc(C(C)=O)ccc1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.51
TNF P01375 1/20 0.49
NOD2 Q9HC29 1/20 0.49
NOD1 Q9Y239 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
BRD4 O60885 3/20 0.48
SMPD1 P17405 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
POLB P06746 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL7111675 0.90 MAOB (0.51) MAOBTNFNOD2NOD1MRGPRX4
SCHEMBL1120927 0.87 NPC1 (0.49) TNFNOD2NOD1BRD4SMPD1
SCHEMBL11671068 0.86 MAOB (0.55) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL7110668 0.85 MRGPRX4 (0.54) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL11879060 0.85 P2RX4 (0.55) MAOBMRGPRX4SMPD1HDAC1HDAC8
SCHEMBL7108182 0.80 ALDH1A1 (0.52) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL3123036 0.80 MAOB (0.64) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL6074797 0.78 PTGDR2 (0.66) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL2010471 0.78 MAOB (0.54) MAOBMRGPRX4BRD4SMPD1HDAC1
SCHEMBL7110050 0.77 SMN1; SMN2 (0.49) BRD4SMPD1HDAC1HDAC8HDAC6

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 3 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
CN-1265651-A Novel tricyclic compound having saturated ring and pharmaceutical composition thereof ASAHI CHEMICAL IND (JP) 2000-09-06 CN 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