SCHEMBL27376325

SCHEMBL27376325

Cc1cc2c(cc1C1=NNC(C=O)CC1)NC(=O)C(C)O2

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 4/20 0.42
PDE3A Q14432 4/20 0.42
PARP1 P09874 7/20 0.35
SMYD3 Q9H7B4 2/20 0.33
CECR2 Q9BXF3 1/20 0.31

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
SCHEMBL27362449 0.82 PDE3B (0.52) PDE3BPDE3APARP1
SCHEMBL27528568 0.82 PDE3B (0.64) PDE3BPDE3APARP1SMYD3
SCHEMBL7342522 0.79 PDE3B (0.66) PDE3BPDE3APARP1SMYD3
SCHEMBL27447337 0.77
SCHEMBL27381477 0.74
SCHEMBL27447335 0.72 PDE3B (0.41) PDE3BPDE3A
SCHEMBL27376326 0.72
SCHEMBL5671394 0.70 PARP1 (0.56) PDE3BPDE3APARP1SMYD3CECR2
SCHEMBL27381476 0.69 PDE3B (0.41) PDE3BPDE3A
SCHEMBL7349308 0.69 PDE3B (0.70) PDE3BPDE3A

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
CN-1071427-A 6-Benzoxazinyl and 6-benzothiazine base-2,3,4,5-tetrahydro pyridazine-3-ketone ORTHO PHARMA CORP (US) 1993-04-28 CN disclosed
CN-87108354-A 6-benzoxazinyl and 6-benzothiazinyl-2, 3, 4, 5-tetrahydropyridazin-3-ones 1988-09-21 CN disclosed