SCHEMBL10763565

SCHEMBL10763565

CCCc1[nH]c(=O)c(C)cc1-c1ccc(-n2ccnc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 8/20 0.53
▸ PDE3A Q14432 8/20 0.53
▸ PDE2A O00408 3/20 0.53
▸ PDE1A P54750 1/20 0.53
▸ PDE1B Q01064 1/20 0.53
▸ PDE1C Q14123 1/20 0.53
▸ ADH5 P11766 6/20 0.48
▸ PDE4A P27815 2/20 0.44
▸ PDE4B Q07343 2/20 0.44
▸ PDE4C Q08493 2/20 0.44
▸ PDE4D Q08499 2/20 0.44

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
SCHEMBL10763411 0.93 PDE3B (0.51) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10756489 0.91 PDE3B (0.55) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10762139 0.83 PDE3B (0.72) PDE3BPDE3APDE2APDE1APDE1B
Hydrochloric Acid SCHEMBL10761419 0.82 PDE3B (0.71) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10365667 0.81 PDE4A (0.38) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10363632 0.80 PDE3B (0.38) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10363624 0.75 PDE4A (0.37) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL10365547 0.74 PDE4A (0.36) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL11118932 0.73 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10363623 0.72 PDE4A (0.44) PDE3BPDE3APDE2APDE1APDE1B

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-4699914-A CONGESTIVE HEART FAILURE A. NATTERMANN & CIE GMBH (DE) 1987-10-13 — — US disclosed
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