SCHEMBL9036166

SCHEMBL9036166

CCN(CC)CCN(CC1CCCCCCC1)C(=O)CCCCOc1ccc2c(c1)CCC(=O)N2OC(=O)C(=O)ON1C(=O)CCc2cc(OCCCCC(=O)N(CCN(CC)CC)CC3CCCCCCC3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 13/20 0.39
PDE3A Q14432 13/20 0.39
F2 P00734 2/20 0.37
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
PDE2A O00408 4/20 0.36
P2RY12 Q9H244 4/20 0.36

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
SCHEMBL11067561 0.79 PDE3B (0.40) PDE3BPDE3APDE2AP2RY12
Oxalic Acid SCHEMBL9036161 0.79 PDE3B (0.59) PDE3BPDE3AMAOAMAOB
SCHEMBL9035670 0.75 PDE3B (0.41) PDE3BPDE3AMAOAMAOBPDE2A
SCHEMBL9035070 0.75 PDE3B (0.41) PDE3BPDE3APDE2AP2RY12
SCHEMBL9035287 0.75 PDE3B (0.61) PDE3BPDE3APDE2AP2RY12
SCHEMBL11060120 0.73 PDE3B (0.43) PDE3BPDE3AP2RY12
SCHEMBL9283568 0.71 PDE3B (0.58) PDE3BPDE3APDE2AP2RY12
SCHEMBL11067264 0.70 PDE3B (0.63) PDE3BPDE3AMAOAMAOB
SCHEMBL9035659 0.70 MEN1 (0.36) PDE3BPDE3APDE2AP2RY12
SCHEMBL11067800 0.69 PDE3B (0.62) PDE3BPDE3AMAOAMAOB

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