SCHEMBL14839643

SCHEMBL14839643

Cc1cncc(Cl)c1CC(O)c1ccc(OC(F)F)c(OCC2CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 20/20 0.66
PDE4B Q07343 20/20 0.66
PDE4C Q08493 20/20 0.66
PDE4D Q08499 20/20 0.66
ABCB11 O95342 1/20 0.54

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
SCHEMBL14839488 1.00 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL2782203 0.93 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL29723157 0.93 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL14165062 0.93 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL15786231 0.93 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL13212480 0.93 PDE4A (0.75) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL15790650 0.89 PDE4B (0.55) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL19673799 0.89 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL15790651 0.88 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DABCB11
SCHEMBL16802335 0.87 PDE4B (0.49) PDE4APDE4BPDE4CPDE4DABCB11

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2928869-B1 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS CHIESI FARM SPA (IT) 2019-02-20 EP disclosed
WO-2013045280-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-04-04 WO disclosed