SCHEMBL7318331

SCHEMBL7318331

O=C1NC2=Nc3ccc(Cl)c(OCCCCCC(=O)N(Cc4ccccc4)Cc4ccccc4)c3CN2C1CO

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 19/20 0.48
PDE3A Q14432 19/20 0.48
LMNA P02545 2/20 0.36
TSHR P16473 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
BLM P54132 1/20 0.36
NPC1 O15118 1/20 0.36
ALOX15 P16050 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 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
SCHEMBL7306886 0.85 PDE3B (0.48) PDE3BPDE3ALMNATSHRNPC1
SCHEMBL7312688 0.84 PDE3B (0.51) PDE3BPDE3A
SCHEMBL7316240 0.81 PDE3B (0.71) PDE3BPDE3A
SCHEMBL7317020 0.80 PDE3B (0.51) PDE3BPDE3ALMNATSHRNPC1
SCHEMBL7318939 0.79 PDE3B (0.50) PDE3BPDE3A
SCHEMBL7312634 0.79 PDE3B (0.44) PDE3BPDE3ANPC1
SCHEMBL7319732 0.78 PDE3B (0.42) PDE3BPDE3ALMNATSHRNPC1
SCHEMBL7313823 0.76 PDE3B (0.53) PDE3BPDE3A
SCHEMBL7318826 0.75 PDE3B (0.58) PDE3BPDE3A
SCHEMBL7317488 0.75 PDE3B (0.47) PDE3BPDE3A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4670434-A ANTICOAGULANT, INOTROPIC AGENT SYNTEX (U.S.A.) INC. (US) 1987-06-02 US disclosed