SCHEMBL8535241

SCHEMBL8535241

COC(=O)N1CCC(c2cc(N)ccc2OC)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.50
PDE4A P27815 1/20 0.50
PDE4C Q08493 1/20 0.50
PDE4D Q08499 1/20 0.50
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
RAD52 P43351 1/20 0.45
GFER P55789 1/20 0.45
QDPR P09417 1/20 0.45
RBP4 P02753 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ADAM17 P78536 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
SCHEMBL4771915 0.88 MEN1 (0.52) PDE4BMEN1KMT2AQDPRALDH1A1
SCHEMBL5515302 0.88 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL6815771 0.84 MEN1 (0.45) PDE4BMEN1KMT2AQDPRRBP4
SCHEMBL8534478 0.81 MEN1 (0.71) MEN1KMT2AALDH1A1MAPT
SCHEMBL7029357 0.80 QDPR (0.52) MEN1KMT2AQDPRALDH1A1LMNA
SCHEMBL4206124 0.80 PDE4B (0.48) PDE4BMEN1KMT2A
SCHEMBL7938441 0.80 KDM4E (0.46) ALDH1A1LMNAMAPT
SCHEMBL6924205 0.78 ABCB1 (0.43) ALDH1A1LMNAMAPT
SCHEMBL31257859 0.78 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL282618 0.78 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DMEN1

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-0819126-A1 BIPHENYLAMIDE DERIVATIVES AS 5HT 1D? ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-01-21 EP disclosed
WO-1996031508-A1 BIPHENYLAMIDE DERIVATIVES AS 5HT1D ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-10-10 WO disclosed