SCHEMBL7367182

SCHEMBL7367182

COc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1OC

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.80
PIM1 P11309 1/20 0.80
MAPK8 P45983 1/20 0.80
CLK4 Q9HAZ1 1/20 0.80
ALDH1A1 P00352 3/20 0.74
PKM P14618 2/20 0.70
PDE4D Q08499 1/20 0.69
KMT2A Q03164 4/20 0.66
MEN1 O00255 3/20 0.66
LMNA P02545 1/20 0.66
KDM4E B2RXH2 3/20 0.65
NPC1 O15118 2/20 0.63
RAB9A P51151 2/20 0.63
HTT P42858 1/20 0.63
KCNH2 Q12809 1/20 0.63
NPSR1 Q6W5P4 2/20 0.62
TSHR P16473 1/20 0.61
HSD17B10 Q99714 1/20 0.61
FLT3 P36888 1/20 0.61
PDE5A O76074 1/20 0.61

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
SCHEMBL24489009 0.90 KMT2A (0.80) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL29579206 0.90 KMT2A (0.80) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL266453 0.89 CHEK1 (0.76) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL266327 0.89 CHEK1 (0.80) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL10026584 0.89 CHEK1 (1.00) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL11244161 0.88 PDE4D (0.81) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL8638460 0.88 L3MBTL1 (0.65) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL13576585 0.85 PDE4D (0.76) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL30452165 0.83 PDE4D (0.72) CHEK1PIM1MAPK8CLK4ALDH1A1
SCHEMBL23202497 0.83 PDE4D (0.72) CHEK1PIM1MAPK8CLK4ALDH1A1

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-6103729-A PREVENTION OR TREATMENT OF RESPIRATORY SYSTEM RELATED DISEASES, E.G., BRONCHIAL ASTHMA; ENZYME INHIBITOR OF PHOSPHODIESTERASE IV; ANTIINFLAMMATORY AND SPASMODIC AGENTS; RELAXANTS CHEIL JEDANG CORP. (KR) 2000-08-15 US disclosed
EP-0855387-A1 2-ACYLAMINOBENZAMIDE DERIVATIVES AND PREVENTIVE AND REMEDY FOR DISEASES CAUSED BY THE SUPERMULTIPLICATION OF VASCULAR INTIMAL CELLS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed
WO-1998023620-A1 CATHECOL DERIVATIVES AND A METHOD FOR THE PREPARATION THEREOF AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME CHEIL JEDANG CORPORATION (KR) 1998-06-04 WO disclosed