SCHEMBL14865178

SCHEMBL14865178

CNc1ncc2c(n1)CCC(C#N)(c1ccc(OC)c3oc4ccccc4c13)C2

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.33
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAOA P21397 1/20 0.30
RAB9A P51151 1/20 0.30
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL4013156 0.90 HRH4 (0.33) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4010173 0.89 PDE4B (0.34) PDE4BNPC1RAB9ACYP17A1CYP19A1
SCHEMBL4018297 0.85 CYP17A1 (0.33) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4526001 0.82 PDE4B (0.33) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4016579 0.82 MAOA (0.33) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4163937 0.79 MEN1 (0.38) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4525342 0.79 USP7 (0.36) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL14856759 0.79 PDE4B (0.34) PDE4BKDM4ENPC1ALDH1A1LMNA
SCHEMBL4011513 0.78 CYP17A1 (0.32) KDM4ENPC1ALDH1A1LMNAMAOA
SCHEMBL4060696 0.77 HRH4 (0.37)

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-2074106-B1 DIBENZOFURAN DERIVATIVES AS INHIBITORS OF PDE-4 AND PDE-10 MYLAN LAB LTD (IN) 2013-04-17 EP disclosed