SCHEMBL7946974

SCHEMBL7946974

CCOC(=O)c1cc2c(Cl)c(OCOC)cc3c2n1CCCCC3=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
ALOX15 P16050 2/20 0.37
GAA P10253 2/20 0.37
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
PDE3B Q13370 3/20 0.35
PDE3A Q14432 3/20 0.35
MAPK1 P28482 4/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
KCNK3 O14649 1/20 0.34
LMNA P02545 2/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
HPGD P15428 2/20 0.33
CACNA1F O60840 2/20 0.33
CACNA1D Q01668 2/20 0.33
CACNA1S Q13698 2/20 0.33
CACNA1C Q13936 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL7946960 0.90 KCNK3 (0.41) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7955932 0.84 ALDH1A1 (0.43) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7954105 0.82
SCHEMBL7954114 0.81
SCHEMBL7958065 0.79 ALDH1A1 (0.44) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7954130 0.77 ALDH1A1 (0.45) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7946984 0.76 PDE3B (0.45) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7958083 0.75 PDE3B (0.39) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7955709 0.73 ALDH1A1 (0.42) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2
SCHEMBL7955774 0.73 MAPK1 (0.43) ALDH1A1ALOX15GAAKDM4ESMN1; SMN2

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