SCHEMBL10532013

SCHEMBL10532013

CC1(C)OC(=O)Nc2cc3nc(-c4ccc(O)cc4)[nH]c3cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
PDE3B Q13370 1/20 0.52
PDE3A Q14432 1/20 0.52
GUSB P08236 1/20 0.47
NPBWR1 P48145 1/20 0.46
SCD O00767 1/20 0.46
PGR P06401 5/20 0.43
DGAT1 O75907 1/20 0.42
KCNH2 Q12809 1/20 0.42
TOP1 P11387 2/20 0.42
TOP2A P11388 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
AURKB Q96GD4 2/20 0.41
CHEK1 O14757 1/20 0.41

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
SCHEMBL10532573 0.88 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10532459 0.87 PDE4A (0.69) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10532260 0.86 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10534328 0.86 PGR (0.51) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10530387 0.85 NPC1 (0.56) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10530370 0.85 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10532592 0.85 RHEB (0.52) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10534269 0.85 SCD (0.49) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10534246 0.83 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL10532631 0.82 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4831027-A USEFUL IN TREATMENT OF CARDIOVASCULAR DISORDERS DR. KARL THOMAE GMBH (DE) 1989-05-16 US disclosed
EP-0263352-A1 Imidazo-benzoxazinones, their preparation and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1988-04-13 EP disclosed