SCHEMBL7981639

SCHEMBL7981639

COC(=O)Cc1ccccc1C1CCCCN1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 1/20 0.43
DHFR P00374 1/20 0.43
MPO P05164 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL13751425 0.86 MEN1 (0.41) SLC6A3SLC6A2SLC6A4DHFRMPO
SCHEMBL7965472 0.83 MPO (0.46) SLC6A3SLC6A2SLC6A4MPOTDP1
SCHEMBL7708396 0.82 MPO (0.45) SLC6A3SLC6A2SLC6A4MPO
SCHEMBL17345636 0.81 MPO (0.48) SLC6A3SLC6A2SLC6A4MPO
SCHEMBL29456377 0.80 MPO (0.47) SLC6A3SLC6A2SLC6A4MPO
SCHEMBL21516391 0.80 MPO (0.47) SLC6A3SLC6A2SLC6A4MPO
Hydrochloric Acid SCHEMBL21491396 0.79 MPO (0.46) SLC6A3SLC6A2SLC6A4MPOTDP1
SCHEMBL30749274 0.78 MPO (0.46) MPO
SCHEMBL11465324 0.78 MPO (0.46) MPO
SCHEMBL17080017 0.78 KDM4E (0.46) SLC6A3SLC6A2SLC6A4ALDH1A1TSHR

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-1082307-A1 PROCESSES AND INTERMEDIATES FOR PREPARING 2-SUBSTITUTED PIPERIDINE STEREOISOMERS CELGENE CORPORATION (US) 2001-03-14 EP disclosed
WO-1999061425-A1 PROCESSES AND INTERMEDIATES FOR PREPARING 2-SUBSTITUTED PIPERIDINE STEREOISOMERS CELGENE CORPORATION (US) 1999-12-02 WO disclosed