SCHEMBL9035303

SCHEMBL9035303

COCC(O)CN(CC1CCCCC1)C(=O)CCCCOc1ccc2[nH]c(=O)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 17/20 0.59
PDE3A Q14432 17/20 0.59
KDM4E B2RXH2 1/20 0.59
MEN1 O00255 1/20 0.59
PDE5A O76074 1/20 0.59
ALDH1A1 P00352 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
HPGD P15428 1/20 0.59
TSHR P16473 1/20 0.59
PTAFR P25105 1/20 0.59
CYP2C19 P33261 1/20 0.59
BLM P54132 1/20 0.59
PDE1A P54750 1/20 0.59
PDE1B Q01064 1/20 0.59
PMP22 Q01453 1/20 0.59
KMT2A Q03164 1/20 0.59
PDE1C Q14123 1/20 0.59
HSD17B10 Q99714 1/20 0.59
P2RY12 Q9H244 11/20 0.43

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
SCHEMBL9036132 0.92 PDE3B (0.59) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9035795 0.91 PDE3B (0.58) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9035169 0.91 PDE3B (0.58) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9036841 0.91 PDE3B (0.62) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9036967 0.90 PDE3B (0.58) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9036168 0.85 PDE3B (0.64) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9035282 0.85 PDE3B (0.55) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9036148 0.85 PDE3B (0.62) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9035287 0.83 PDE3B (0.61) PDE3BPDE3AKDM4EMEN1PDE5A
SCHEMBL9038332 0.83 PDE3B (0.61) PDE3BPDE3AKDM4EMEN1PDE5A

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 3 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