SCHEMBL4021697

SCHEMBL4021697

O=C(O)c1ccccc1CCCCN1CCC(OC(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 10/20 0.65
CHRM2 P08172 2/20 0.54
HTR1A P08908 2/20 0.54
ADRA2A P08913 2/20 0.54
CHRM1 P11229 2/20 0.54
DRD1 P21728 2/20 0.54
SLC6A2 P23975 2/20 0.54
ADRA1A P35348 2/20 0.54
DRD3 P35462 2/20 0.54
SLC6A3 Q01959 2/20 0.54
KCNH2 Q12809 2/20 0.54
NPC1 O15118 1/20 0.54
MLNR O43193 1/20 0.54
NR1I2 O75469 1/20 0.54
EGFR P00533 1/20 0.54
LMNA P02545 1/20 0.54
ERBB2 P04626 1/20 0.54
FYN P06241 1/20 0.54
CHRM4 P08173 1/20 0.54
ABCB1 P08183 1/20 0.54

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
SCHEMBL4022560 0.88 BCHE (0.56) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4023951 0.88 BCHE (0.64) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4026270 0.88 BCHE (0.64) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4023303 0.87 BCHE (0.65) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4020161 0.84 BCHE (0.66) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4022557 0.84 BCHE (0.57) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4031006 0.84 BCHE (0.57) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4024421 0.84 BCHE (0.57) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4024417 0.83 BCHE (0.64) BCHECHRM2HTR1AADRA2ACHRM1
SCHEMBL4023903 0.83 BCHE (0.64) BCHECHRM2HTR1AADRA2ACHRM1

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-1446400-B1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE CONTAINING THE SAME STC NARA CO LTD (KR) 2009-01-28 EP claimed
EP-1446400-A4 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE CONTAINING THE SAME STC NARA CO LTD (KR) 2005-06-01 EP disclosed
EP-1446400-A1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE CONTAINING THE SAME STC Nara Co. Ltd. (KR) 2004-08-18 EP disclosed
WO-2003033489-A1 PIPERIDINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE CONTAINING THE SAME STC NARA CO., LTD. (KR) 2003-04-24 WO disclosed