SCHEMBL7428441

SCHEMBL7428441

CCOC(=O)N1C(=O)C(C)(C)c2cc(C3=NNC(=O)SC3C)ccc21

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 13/20 0.53
PDE3A Q14432 13/20 0.53
PDE4A P27815 12/20 0.53
PDE4B Q07343 12/20 0.53
PDE4C Q08493 12/20 0.53
PDE4D Q08499 12/20 0.53
KCNH2 Q12809 1/20 0.41
FBP1 P09467 1/20 0.36
CYP2C19 P33261 2/20 0.35
CYP3A4 P08684 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7375763 0.90 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7377678 0.90 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7377312 0.89 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7379251 0.89 PDE4A (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7431591 0.87 PDE3B (0.58) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7381427 0.86 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7429294 0.86 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7429505 0.86 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7381431 0.84 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7438382 0.83 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0303418-A2 Substituted indolones, useful in the treatment of heart or asthmatic diseases SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) 1989-02-15 EP claimed
US-4933336-A Thiadiazinone, oxadiazinone and triazinone derivatives, and their use for treating acute or chronic heart disease LABORATOIRES SOBIO S.A. (FR) 1990-06-12 US disclosed
EP-0303418-A2 Substituted indolones, useful in the treatment of heart or asthmatic diseases SMITHKLINE BEECHAM LABORATOIRES PHARMACEUTIQUES (FR) 1989-02-15 EP disclosed