SCHEMBL6180671

SCHEMBL6180671

CCOc1ccc(NCc2cccc(C)c2)cc1OC1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
GAA P10253 1/20 0.46
C5AR1 P21730 1/20 0.46
HDAC4 P56524 3/20 0.44
MEF2D Q14814 3/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.43
PDE5A O76074 1/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE1C Q14123 1/20 0.43
POLB P06746 2/20 0.41
THRB P10828 1/20 0.41
PDE4D Q08499 2/20 0.41
F2 P00734 1/20 0.41
F10 P00742 1/20 0.41
PRSS1 P07477 1/20 0.41
F7 P08709 1/20 0.41

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
SCHEMBL1157585 0.89 PDE5A (0.54) KMT2AMEN1GAAC5AR1HDAC4
SCHEMBL1157256 0.77 UTS2R (0.57) KMT2AMEN1GAAC5AR1HDAC4
SCHEMBL1157363 0.76 POLB (0.49) KMT2AMEN1C5AR1ALDH1A1MAPT
SCHEMBL1157332 0.76 PDE4A (0.58) KMT2AMEN1C5AR1POLBPDE4D
SCHEMBL21232529 0.76 HDAC4 (0.60) GAAHDAC4MEF2DALDH1A1MAPT
SCHEMBL986245 0.71 PDE4A (0.60) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL1157253 0.71 TUBB4A (0.57) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL1157362 0.70 PDE5A (0.66) PDE5APDE1APDE1BPDE1CPOLB
SCHEMBL986248 0.70 PDE4A (0.58) PDE4D
SCHEMBL1157697 0.70 POLB (0.52) KMT2AMEN1GAAALDH1A1MAPT

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-1539697-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS Memory Pharmaceutical Corporation (US) 2005-06-15 EP disclosed
WO-2004009552-A1 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED ANILINE AND DIPHENYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2004-01-29 WO disclosed