SCHEMBL8890987

SCHEMBL8890987

COc1ccc(Cc2cc(C(=O)Nc3c(Cl)cncc3Cl)ccc2OC)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.66
PDE4A P27815 13/20 0.61
PDE4B Q07343 13/20 0.61
PDE4C Q08493 13/20 0.61
CYP2B6 P20813 1/20 0.58
P2RX7 Q99572 1/20 0.47
GFER P55789 1/20 0.47
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL8889407 0.89 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8891122 0.85 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8890532 0.81 PDE4D (0.70) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL30614148 0.81 PDE4D (0.68) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8891532 0.81 PDE4D (0.66) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL15270505 0.80 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8888978 0.80 PDE4D (0.65) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8889907 0.79 PDE4D (0.64) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8891152 0.78 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL2908650 0.78 PDE4D (0.81) PDE4DPDE4APDE4BPDE4CCYP2B6

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
WO-1997003967-A1 SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE RHONE-POULENC RORER LIMITED (GB) 1997-02-06 WO claimed
WO-1997003967-A1 SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE RHONE-POULENC RORER LIMITED (GB) 1997-02-06 WO disclosed