SCHEMBL7906198

SCHEMBL7906198

COc1ccc(C2CN(Cc3ccc4ccccc4n3)C(=O)CO2)cc1OC1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.51
PDE4B Q07343 8/20 0.46
PDE4C Q08493 4/20 0.46
PDE4D Q08499 4/20 0.46
HCRTR1 O43613 7/20 0.45
HCRTR2 O43614 7/20 0.45

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
SCHEMBL6586257 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DHCRTR1
SCHEMBL7914436 0.81 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL7914394 0.81 PDE4A (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL7916373 0.79 PDE4B (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL7913406 0.78 PDE4A (0.53) PDE4APDE4BPDE4CPDE4D
SCHEMBL7916380 0.76 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL7371694 0.76 PDE4A (0.66) PDE4APDE4BPDE4CPDE4D
SCHEMBL7375481 0.75 PDE4A (0.63) PDE4APDE4BPDE4CPDE4D
SCHEMBL7914409 0.75 PDE4B (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL7919768 0.73 PDE4A (0.46) PDE4APDE4BPDE4CPDE4D

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-6265402-B1 ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-07-24 US disclosed
EP-0924204-A1 2-PHENYLMORPHOLIN-5-ONE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Nikken Chemicals Company, Limited (JP) 1999-06-23 EP disclosed