SCHEMBL27748883

SCHEMBL27748883

COC1CCN(C(=O)c2ccccc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.68
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
HPGD P15428 2/20 0.61
LMNA P02545 1/20 0.60
EPHX1 P07099 1/20 0.58
L3MBTL3 Q96JM7 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
BACE1 P56817 2/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 1/20 0.54
GAA P10253 1/20 0.54
KDM4E B2RXH2 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
SIGMAR1 Q99720 1/20 0.53
BLM P54132 1/20 0.53
MGLL Q99685 1/20 0.52

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
SCHEMBL25772130 0.90 ACHE (0.59) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL28355752 0.89 HPGD (0.56) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL31003116 0.85 HSD11B1 (0.57) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL10196662 0.85 KMT2A (0.65) KMT2AMEN1HPGDLMNAL3MBTL3
SCHEMBL744630 0.84 LMNA (0.49) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL19915895 0.84 MGLL (0.56) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL28355937 0.84 EPHX1 (0.54) KMT2AMEN1HPGDLMNAEPHX1
SCHEMBL95384 0.84 HPGD (0.52) ACHEKMT2AMEN1HPGDLMNA
SCHEMBL7809522 0.84 ACHE (0.64) ACHEKMT2AMEN1HPGDEPHX1
SCHEMBL4678438 0.83 ACHE (0.63) ACHEKMT2AMEN1HPGDEPHX1

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
CN-101360737-A 2-amino-5-piperidinylimidazolone compounds and their use for beta secretase modulation WYETH CORP (US) 2009-02-04 CN disclosed