SCHEMBL7276028

SCHEMBL7276028

Cc1ccc(NN=C2C(=O)Nc3ccc(C4=NNC(=O)SC4C)cc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 10/20 0.48
PDE3A Q14432 10/20 0.48
PDE4A P27815 7/20 0.48
PDE4B Q07343 7/20 0.48
PDE4C Q08493 7/20 0.48
PDE4D Q08499 7/20 0.48
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
AGTR1 P30556 1/20 0.36
FBP1 P09467 1/20 0.36
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7276125 0.91 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7269474 0.91 PDE4A (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7267327 0.91 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7273763 0.90 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7267004 0.90 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7267008 0.90 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9876328 0.89 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7269335 0.89 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9876327 0.89 PDE3B (0.46) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9879907 0.88 PDE3B (0.46) 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 4 patents. 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
EP-0351213-A2 2-Indolones substituted in 5 by a cyclic hydrazide radical, their preparation and their use in cardio-active medicaments LES LABORATOIRES BEECHAM S.A. (FR) 1990-01-17 EP claimed
US-5051417-A Indolythiadiazines for treating heart failure LES LABORATOIRES BEECHAM S.A. (FR) 1991-09-24 US disclosed
EP-0351213-A2 2-Indolones substituted in 5 by a cyclic hydrazide radical, their preparation and their use in cardio-active medicaments LES LABORATOIRES BEECHAM S.A. (FR) 1990-01-17 EP disclosed