SCHEMBL11062841

SCHEMBL11062841

CC(O)CN(C(=O)CCCCOc1ccc2c(c1)CCC(=O)N2)C1CCCCC1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 19/20 0.70
PDE3A Q14432 19/20 0.70
PDE4D Q08499 2/20 0.48
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
MEN1 O00255 1/20 0.48
ABCC4 O15439 1/20 0.48
CACNA1F O60840 1/20 0.48
ABCB11 O95342 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
CYP2C9 P11712 1/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
THPO P40225 1/20 0.48
OPRK1 P41145 1/20 0.48

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
SCHEMBL11061196 0.97 PDE3B (0.74) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11062206 0.91 PDE3B (0.68) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11066237 0.91 PDE3B (0.67) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11065602 0.90 PDE3B (0.69) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11066227 0.90 PDE3B (0.66) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11058697 0.89 PDE3B (0.71) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11068183 0.88 PDE3B (0.70) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11067563 0.87 PDE3B (0.69) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11066074 0.87 PDE3B (0.71) PDE3BPDE3APDE4DPDE4APDE4B
SCHEMBL11064367 0.86 PDE3B (0.70) PDE3BPDE3APDE4DPDE4APDE4B

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
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US claimed
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed