SCHEMBL11359883

SCHEMBL11359883

CC(COc1ccc2c(c1Cl)CCC(=O)N2)CC(=O)N(C)C1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 9/20 0.48
PDE3A Q14432 9/20 0.48
NPSR1 Q6W5P4 2/20 0.41
NPC1 O15118 2/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TP53 P04637 1/20 0.36
KDM4E B2RXH2 2/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36

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
SCHEMBL11317577 0.78 ADRB1 (0.47) PDE3BPDE3ALMNAKMT2AMEN1
SCHEMBL11317207 0.73 PDE3B (0.52) PDE3BPDE3ANPSR1NPC1LMNA
SCHEMBL11320635 0.71 PDE3B (0.64) PDE3BPDE3AKMT2AMEN1ALDH1A1
SCHEMBL11312325 0.70 PDE3B (0.60) PDE3BPDE3AKMT2AMEN1ALDH1A1
SCHEMBL11323296 0.69 RAB9A (0.49) PDE3BPDE3ALMNAKMT2AMEN1
SCHEMBL11313435 0.69 ATM (0.41) PDE3BPDE3ALMNAKMT2AMEN1
SCHEMBL11317240 0.69 PDE3B (0.56) PDE3BPDE3ANPSR1LMNAKMT2A
SCHEMBL11070251 0.69 ADRB1 (0.44) SMN1; SMN2
SCHEMBL11062648 0.68 PDE3B (0.57) PDE3BPDE3ANPSR1LMNAKMT2A
SCHEMBL11064885 0.67 ADRB1 (0.44) KMT2AMEN1KDM4E

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-4298739-A ANTICOAGULANTS, ANTIINFLAMMATORY, ANTIULCER, VASODILATOR, PHOSPHODIESTERASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1981-11-03 US disclosed