SCHEMBL7319736

SCHEMBL7319736

CN(C)c1ccccc1OC(=O)CN1Cc2c(cccc2OCCCC(=O)N(Cc2ccccc2)Cc2ccccc2)N=C1NC(=O)N(C1CCCCC1)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 3/20 0.44
PDE3A Q14432 3/20 0.44
PDE4A P27815 16/20 0.41
PDE4B Q07343 16/20 0.41
PDE4C Q08493 16/20 0.41
PDE4D Q08499 16/20 0.41
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL7312876 0.87 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7317951 0.86 PDE3B (0.35) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7314675 0.82 PDE3B (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7308383 0.81 PDE3B (0.41) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7320575 0.80 PDE3B (0.34) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7316080 0.80 PDE3B (0.36) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7320082 0.80 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10665307 0.77 PDE4A (0.40) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7308378 0.77 PDE3B (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7310529 0.76 PDE3B (0.35) 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