SCHEMBL27656141

SCHEMBL27656141

O=C(O)/C(O)=C(\C(=O)O)c1cccc2ncc3ccccc3c12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
GPR3 P46089 1/20 0.44
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
MGAM O43451 1/20 0.38
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PIM1 P11309 1/20 0.36
CDC25B P30305 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TOP2A P11388 1/20 0.34

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
SCHEMBL27656146 1.00 KDM4E (0.44) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL5358564 0.84 NR4A1 (0.53) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL28032410 0.82 KDM4E (0.52) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL5358558 0.81 KDM4E (0.50) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL18663455 0.80 KDM4E (0.46) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL8230482 0.80 PIM1 (0.50) KDM4EGPR3ALDH1A1MEN1KMT2A
SCHEMBL30075099 0.78 KDM4E (0.50) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL27546968 0.77 KDM4E (0.46) KDM4EGPR3NR4A1NR4A2NR4A3
SCHEMBL3862098 0.74 LIG1 (0.46) KDM4EGPR3MGAMALDH1A1HPGD
SCHEMBL28177676 0.72 NR4A1 (0.53) KDM4EGPR3NR4A1NR4A2NR4A3

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
CN-104817534-A Novel hydroxy-6-heteroarylphenanthridines and their use as PDE4 inhibitors ALTANA PHARMA AG 2015-08-05 CN disclosed
CN-104803974-A Novel hydroxy-6-heteroarylphenanthridines and their use as PDE4 inhibitors TAKEDA GMBH 2015-07-29 CN disclosed
CN-104803973-A Novel hydroxy-6-heteroarylphenanthridines and their use as pde4 inhibitors TAKEDA GMBH 2015-07-29 CN disclosed
CN-104761545-A NOVEL HYDROXY-6-HETEROARYLPHENANTHRIDINES AND THEIR USE AS PDE4 INHIBITORS TAKEDA GMBH 2015-07-08 CN disclosed
CN-102295634-A Novel hydroxy-6-heteroarylphenanthridines and their use as pde4 inhibitors 2011-12-28 CN disclosed
CN-1922170-A Novel hydroxy-6-heteroarylphenanthridines and their use as PDE4 ALTANA PHARMA AG (DE) 2007-02-28 CN disclosed