SCHEMBL7617448

SCHEMBL7617448

CCCCCCCC(=O)CC[C@@H]1[C@@H](CC=CCCCCCCCC(=O)OC(C)C)[C@@H](O)C[C@H]1O

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.96
PGR P06401 1/20 0.96
ADORA3 P0DMS8 1/20 0.96
ADRA2C P18825 1/20 0.96
SLC6A2 P23975 1/20 0.96
HTR2B P41595 1/20 0.96
MC3R P41968 1/20 0.96
SLC6A3 Q01959 1/20 0.96
SCN5A Q14524 1/20 0.96
KDM4E B2RXH2 2/20 0.54
PTGFR P43088 2/20 0.54
MEN1 O00255 1/20 0.54
ABCB11 O95342 1/20 0.54
MAPT P10636 1/20 0.54
MAPK1 P28482 1/20 0.54
KMT2A Q03164 1/20 0.54
LMNA P02545 3/20 0.48
ALDH1A1 P00352 3/20 0.47
HKDC1 Q2TB90 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL7617442 1.00 PDE4D (0.96) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL14674258 0.98 PDE4D (1.00) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL5971186 0.98 PDE4D (1.00) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL7562527 0.98 PDE4D (1.00) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL22965374 0.98 PDE4D (1.00) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL192726 0.98 PDE4D (1.00) PDE4DPGRADORA3ADRA2CSLC6A2
Unoprostone Isopropyl SCHEMBL2552761 0.94 PGR (0.92) PDE4DPGRADORA3ADRA2CSLC6A2
SCHEMBL7617428 0.93 PDE4D (0.82) PDE4DPGRADORA3ADRA2CSLC6A2
SCHEMBL7617431 0.93 PDE4D (0.82) PDE4DPGRADORA3ADRA2CSLC6A2
SCHEMBL7617422 0.93 PDE4D (0.82) PDE4DPGRADORA3ADRA2CSLC6A2

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-6452039-B1 PROSTANOIC ACID DERIVATIVE WHEREIN THE ALPHA CHAIN HAS EIGHT OR MORE SKELETAL CARBON ATOMS; EXTREMELY STRONG ACTION; HYPERTENSION, ASTHMA, DIABETES, ARTERIAL SCLEROSIS, RENAL FAILURE, CARDIAC INFARCTION, ANGINA PECTORIS SUCAMPO AG (CH) 2002-09-17 US disclosed
EP-0857718-B1 ENDOTHELIN ANTAGONIST SUCAMPO AG (CH) 2002-08-14 EP disclosed
US-6242485-B1 ADMINISTERING PROSTANOIC ACID DERIVATIVE TO TREAT VISION, KIDNEY, CARDIOVASCULAR AND BRAIN DISORDERS; HYPOTENSIVE AND ANTIASTHMATIC AGENTS R-TECH UENO (JP) 2001-06-05 US disclosed
EP-0857718-A1 ENDOTHELIN ANTAGONIST R-Tech Ueno, Ltd. (JP) 1998-08-12 EP disclosed