SCHEMBL14734792

SCHEMBL14734792

CC[C](C)Oc1c(-c2ccc3c(c2)COC3=O)ccc(OC)c1OC

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
LMNA P02545 1/20 0.47
PRF1 P14222 3/20 0.45
CYP3A4 P08684 1/20 0.44
PDE4D Q08499 8/20 0.44
MAPT P10636 2/20 0.43
IMPDH2 P12268 1/20 0.42
ABCG2 Q9UNQ0 2/20 0.41
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL2589152 0.88 PRF1 (0.47) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14737690 0.85 KDM4E (0.49) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14738209 0.84 PDE4D (0.46) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14738144 0.84 PDE4D (0.48) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14737293 0.83 PDE4D (0.46) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14737770 0.83 PDE4D (0.47) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL2593168 0.83 CYP3A4 (0.51) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL2596115 0.83 CYP3A4 (0.51) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL14735883 0.83 PDE4D (0.46) KDM4ELMNAPRF1CYP3A4PDE4D
SCHEMBL7716197 0.82 PRF1 (0.46) KDM4ELMNAPRF1CYP3A4PDE4D

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
EP-2563770-A1 BIARYL PHOSPHODIESTERASE INHIBITORS Leo Pharma A/S (DK) 2013-03-06 EP disclosed