SCHEMBL7320518

SCHEMBL7320518

CC(O)C1CCN(C(=O)c2ccccc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.66
ALDH1A1 P00352 2/20 0.63
EPHX1 P07099 1/20 0.56
L3MBTL3 Q96JM7 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
BLM P54132 1/20 0.55
HPGD P15428 1/20 0.54
KMT2A Q03164 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 2/20 0.52
KDM4E B2RXH2 1/20 0.52
POLB P06746 1/20 0.52
SIGMAR1 Q99720 1/20 0.51
MGLL Q99685 1/20 0.51
HSD11B1 P28845 1/20 0.51
GRM5 P41594 1/20 0.51

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
SCHEMBL9304959 0.91 ACHE (0.58) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL2603247 0.89 ACHE (0.68) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL8539143 0.86 ACHE (0.60) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL9785724 0.86 ACHE (0.64) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
Hydrochloric Acid SCHEMBL9785687 0.84 ACHE (0.62) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL9785683 0.83 ACHE (0.60) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL7288362 0.83 ACHE (0.60) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL12261876 0.83 ACHE (0.59) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL20233114 0.83 ACHE (0.59) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1
SCHEMBL25945885 0.83 ACHE (0.59) ACHEALDH1A1EPHX1L3MBTL3L3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0610192-A1 ETHER DERIVATIVES OF ALKYL PIPERIDINES AND PYRROLIDINES AS ANTIPSYCHOTIC AGENTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-08-17 EP disclosed
US-5317024-A Administering to mammals DUPONT MERCK PHARMACEUTICAL CO. (US) 1994-05-31 US disclosed
US-5252586-A Ether derivatives of alkyl piperidines and pyrrolidines as antipsychotic agents THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-10-12 US disclosed
WO-1993009094-A1 ETHER DERIVATIVES OF ALKYL PIPERIDINES AND PYRROLIDINES AS ANTIPSYCHOTIC AGENTS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-05-13 WO disclosed