SCHEMBL9691872

SCHEMBL9691872

O=C(O)N1CCN(c2ccc3nc4[nH]c(=O)[nH]c4cc3c2)CC1

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 0.78
PDE3A Q14432 20/20 0.78
PDE2A O00408 1/20 0.51
P2RY12 Q9H244 1/20 0.51

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
SCHEMBL9693445 0.88 PDE3B (1.00) PDE3BPDE3A
SCHEMBL9692111 0.86 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9693383 0.85 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9692011 0.85 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9691765 0.84 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9693319 0.84 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9694200 0.82 PDE3B (0.77) PDE3BPDE3APDE2AP2RY12
SCHEMBL9693683 0.81 PDE3B (1.00) PDE3BPDE3APDE2AP2RY12
SCHEMBL9693701 0.80 PDE3B (1.00) PDE3BPDE3A
SCHEMBL9694150 0.79 PDE3B (0.61) PDE3BPDE3APDE2AP2RY12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0252503-B1 AMINOIMIDAZOQUINOLINE DERIVATIVES Bristol-Myers Squibb Company (US) 1992-11-19 EP disclosed
EP-0252503-A1 Aminoimidazoquinoline derivatives Bristol-Myers Squibb Company (US) 1988-01-13 EP disclosed