SCHEMBL9589011

SCHEMBL9589011

CC1CC(=O)N(C)N=C1c1ccc2c(c1)ONC(=O)C2

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 17/20 0.43
PDE3A Q14432 17/20 0.43
PDE4A P27815 4/20 0.40
PDE4B Q07343 4/20 0.40
PDE4C Q08493 4/20 0.40
PDE4D Q08499 4/20 0.40

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
SCHEMBL9589005 0.76 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9588042 0.73 PDE3B (0.69) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11393595 0.72 PDE4A (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL20138813 0.70 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL20159190 0.70 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL20142927 0.70 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11322162 0.70 PDE4A (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10333467 0.67 MAPT (0.46) PDE3BPDE3A
SCHEMBL10333455 0.67 MAPT (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL2474488 0.66 METAP1 (0.42)

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-5221742-A PROCESS FOR THE PREPARATION OF 6-(3,4-DIHYDRO-3-OXO-1,4(2H)-BENZOXAZIN-7-YL)-2,3,4,5-TETRAHYDROPYRIDAZIN-3-ONES ORTHO PHARMACEUTICAL CORPORATION (US) 1993-06-22 US disclosed
WO-1992011256-A1 PROCESS FOR THE PREPARATION OF BENZOXAZINYLTETRAHYDROPYRIDAZINES ORTHO PHARMACEUTICAL CORPORATION (US) 1992-07-09 WO disclosed