SCHEMBL9879960

SCHEMBL9879960

CC1SC(=O)NN=C1c1ccc2c(c1)C(=NNc1ccc(CC(F)(F)F)cc1)C(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 6/20 0.43
PDE4B Q07343 6/20 0.43
PDE4C Q08493 6/20 0.43
PDE4D Q08499 6/20 0.43
PDE3B Q13370 6/20 0.43
PDE3A Q14432 6/20 0.43
FBP1 P09467 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
KCNH2 Q12809 1/20 0.30

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
SCHEMBL9876328 0.89 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL9876327 0.89 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7276125 0.88 PDE3B (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7276028 0.87 PDE3B (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7267008 0.86 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7267004 0.86 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7269474 0.86 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7267327 0.86 PDE3B (0.49) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7273763 0.84 PDE3B (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL7269335 0.83 PDE3B (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5051417-A Indolythiadiazines for treating heart failure LES LABORATOIRES BEECHAM S.A. (FR) 1991-09-24 US claimed