SCHEMBL7319316

SCHEMBL7319316

CC(C)CNC(=O)CN1Cc2cccc(OCCCC(=O)N(C)c3ccccc3)c2N=C1NC(=O)Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
PDE4A P27815 4/20 0.35
PDE4B Q07343 4/20 0.35
PDE4C Q08493 4/20 0.35
PDE4D Q08499 4/20 0.35
HPGD P15428 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
NTSR1 P30989 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
NOD2 Q9HC29 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PRMT5 O14744 4/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
NAMPT P43490 1/20 0.31

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
SCHEMBL7309755 0.90 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7314037 0.89 PDE4A (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311053 0.89 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7307830 0.89 PDE4A (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7321476 0.86 PDE4A (0.42) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7319317 0.80 PDE4A (0.43) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7311966 0.79 PDE4A (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7307685 0.78 PPIA (0.37) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317651 0.77 PDE3B (0.38) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316967 0.77 TSHR (0.37) 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-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed