SCHEMBL7309547

SCHEMBL7309547

C=c1c(=O)[nH]c2n1Cc1cc(OCCCC(=O)N(C)C3CCCCCCC3)ccc1N=2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 20/20 1.00
PDE3A Q14432 20/20 1.00
PDE4A P27815 1/20 0.66
PDE4B Q07343 1/20 0.66
PDE4C Q08493 1/20 0.66
PDE4D Q08499 1/20 0.66
P2RY12 Q9H244 1/20 0.66

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
SCHEMBL7308506 1.00 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7318394 1.00 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL7308823 0.99 PDE3B (0.98) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7306899 0.99 PDE3B (0.98) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319607 0.97 PDE3B (0.94) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7312829 0.97 PDE3B (0.94) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317649 0.93 PDE3B (0.88) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7313147 0.92 PDE3B (0.86) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319277 0.90 PDE3B (0.82) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316313 0.90 PDE3B (0.82) PDE3BPDE3APDE4APDE4BPDE4C

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 claimed