SCHEMBL7955768

SCHEMBL7955768

CCOC(=O)c1cc2c(Cl)cc(OC)cc2n1CCCCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 6/20 0.42
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
GLA P06280 1/20 0.40
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
POLB P06746 1/20 0.37
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
PLA2G2A P14555 1/20 0.36

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
SCHEMBL7954481 0.92 TNF (0.43) DYRK1AKDM4EMAPTMAPK1TDP1
SCHEMBL7947029 0.83 FABP4 (0.49) KMT2AMEN1GLAKDM4EMAPT
SCHEMBL7955848 0.80 KMT2A (0.46) KMT2AMEN1GLAKDM4EMAPT
SCHEMBL7947037 0.79 PLA2G2A (0.49) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL7954138 0.78 TNF (0.40) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL7955770 0.76 CNR1 (0.41) KMT2AMEN1GLAMAPTNPSR1
SCHEMBL8690553 0.75 OXER1 (0.40) DYRK1AKMT2AMEN1
SCHEMBL7956149 0.74 L3MBTL1 (0.47) KDM4EMAPTMAPK1TDP1L3MBTL1
SCHEMBL7961092 0.72 F10 (0.55) KMT2AMEN1GLAKDM4EMAPT
SCHEMBL7955926 0.72 TNF (0.47) KMT2AKDM4EMAPTMAPK1TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271251-B1 CARDIOVASCULAR DISORDERS SUMITOMO PHARMACEUTICALS COMPANY LIMITED (JP) 2001-08-07 US disclosed
US-5977100-A Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5834454-A TREATMENT OF ANGINA, ISCHEMIA, ARRHYTHMIA SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-11-10 US disclosed
EP-0787728-A1 Substituted guanidine derivatives, process for production thereof, and pharmaceutical uses thereof SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-08-06 EP disclosed