SCHEMBL6590146

SCHEMBL6590146

O=c1oc2cc(O)cc(O)c2c2c1CC(c1ccccc1)CC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
CYP3A4 P08684 4/20 0.42
ABCB1 P08183 3/20 0.42
MAOA P21397 3/20 0.42
CYP2D6 P10635 3/20 0.42
CYP2C9 P11712 3/20 0.42
CYP2C19 P33261 3/20 0.42
TP53 P04637 3/20 0.42
CA12 O43570 2/20 0.42
CYP1A1 P04798 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP19A1 P11511 2/20 0.42
CA4 P22748 2/20 0.42
MAOB P27338 2/20 0.42
PPARG P37231 2/20 0.42
CA7 P43166 2/20 0.42

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
SCHEMBL6587683 0.75 ALDH1A1 (0.43) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL14454479 0.74 ALDH1A1 (0.50) MAPTALDH1A1KDM4ECYP3A4MAOA
SCHEMBL13016751 0.73 MAOA (0.58) MAPTALDH1A1KDM4ECYP3A4MAOA
SCHEMBL6585928 0.73 ALDH1A1 (0.58) MAPTALDH1A1KDM4ECYP3A4MAOA
SCHEMBL6586439 0.71 MEN1 (0.39) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL7537433 0.68 DRD4 (0.49) MAPTALDH1A1KDM4EKMT2APPARG
SCHEMBL31059962 0.66 MGAM (0.64) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL26779740 0.66 MGAM (0.64) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL29038494 0.65 MEN1 (0.63) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL17949797 0.64 GAA (0.51) MAPTALDH1A1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001774-B1 USE OF PHOSPHOLAMBAN INHIBITORS FOR INCREASING CORONARY FLOW ORION CORP (FI) 2004-09-15 EP disclosed
US-6774103-B1 Compounds for deactivating phospholamban function on Ca-ATPase (phospholamban inhibitors) ORION CORPORATION (FI) 2004-08-10 US disclosed
US-6538022-B1 Three-dimensional structure of the cytosolic domain of phospholamban (PLB) and its active site from NMR data of sufficiently high resolution for the three-dimensional structure determination. rational drug design enabling the ORION CORPORATION (FI) 2003-03-25 US disclosed
EP-1039884-B1 A METHOD FOR THE PREVENTION AND TREATMENT OF STUNNED MYOCARDIUM ORION CORP (FI) 2002-09-18 EP disclosed
US-6265421-B1 DILATATION OF ARTERIES ORION CORPORATION (FI) 2001-07-24 US disclosed
US-5968959-A ADMINISTERING PHOSPHOLAMBAN INHIBITOR ORION CORPORATION (FI) 1999-10-19 US disclosed