SCHEMBL7317560

SCHEMBL7317560

CNC(=O)C(CCCCCOc1ccc2c(c1)CN1C(=N2)NC(=O)C1CO)N1CCNCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 0.56
PDE3A Q14432 20/20 0.56
P2RY12 Q9H244 1/20 0.41

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
SCHEMBL10844798 0.81 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10846602 0.81 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10844136 0.81 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10841917 0.80 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10844185 0.80 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10850055 0.80 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10842404 0.80 PDE3B (0.65) PDE3BPDE3AP2RY12
SCHEMBL10845961 0.80 PDE3B (0.66) PDE3BPDE3AP2RY12
SCHEMBL7309032 0.79 PDE3B (0.58) PDE3BPDE3AP2RY12
SCHEMBL10374637 0.79 PDE3B (0.65) PDE3BPDE3AP2RY12

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