SCHEMBL9036675

SCHEMBL9036675

CC(=O)OCC(CN(CC1CCCCO1)C(=O)CCCCOc1ccc2[nH]c(=O)ccc2c1)OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.51
PDE3B Q13370 10/20 0.51
PDE3A Q14432 10/20 0.51
HPGD P15428 7/20 0.51
HSD17B10 Q99714 7/20 0.51
KDM4E B2RXH2 6/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
PDE5A O76074 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
PTAFR P25105 1/20 0.51
CYP2C19 P33261 1/20 0.51
BLM P54132 1/20 0.51
PDE1A P54750 1/20 0.51
PDE1B Q01064 1/20 0.51
PMP22 Q01453 1/20 0.51
PDE1C Q14123 1/20 0.51
PDE2A O00408 5/20 0.38

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
SCHEMBL9035282 0.90 PDE3B (0.55) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL9036125 0.84 PDE3B (0.61) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL11066631 0.81 PDE3B (0.63) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL11062114 0.81 PDE3B (0.60) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL11071229 0.80 PDE3B (0.67) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL11065347 0.78 PDE3B (0.65) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL9036841 0.76 PDE3B (0.62) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL9035303 0.76 PDE3B (0.59) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL9036168 0.74 PDE3B (0.64) ALDH1A1PDE3BPDE3AHPGDHSD17B10
SCHEMBL9037169 0.74 PDE3B (0.53) ALDH1A1PDE3BPDE3AHPGDHSD17B10

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
EP-0450066-B1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMA CO LTD (JP) 1996-09-11 EP disclosed
US-5401740-A FOR INHIBITING PLATELET AGGREGATION OTSUKA PHARMACEUTICAL CO. (JP) 1995-03-28 US disclosed
US-5227381-A Anticoagulant OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-13 US disclosed
EP-0450066-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-10-09 EP disclosed