SCHEMBL5358535

SCHEMBL5358535

CC(C)(C)[SiH2]OC(C)(C)C1(c2ccccc2)CCN(CC2(c3cccc(F)c3)CCCC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.41
SLC6A3 Q01959 5/20 0.41
SLC6A2 P23975 5/20 0.41
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TACR1 P25103 3/20 0.34
PARK7 Q99497 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRL1 P41146 2/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
ICMT O60725 1/20 0.31
ACHE P22303 1/20 0.31

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
SCHEMBL5357737 0.83 P2RX7 (0.38) ALDH1A1OPRM1OPRL1
SCHEMBL5369345 0.82 SLC6A2 (0.36) SLC6A4SLC6A3SLC6A2OPRM1OPRL1
SCHEMBL5365666 0.78 MEN1 (0.45) CYP2C19ALDH1A1OPRD1OPRK1
SCHEMBL5358531 0.74 SLC6A4 (0.41) SLC6A4SLC6A3SLC6A2ALDH1A1TACR1
SCHEMBL14417007 0.74 SLC6A4 (0.47) SLC6A4SLC6A3SLC6A2CYP2C19ALDH1A1
SCHEMBL5358527 0.73 SLC6A4 (0.42) SLC6A4SLC6A3SLC6A2CYP2C19ALDH1A1
SCHEMBL5372808 0.71 SIGMAR1 (0.56) ALDH1A1
SCHEMBL14417006 0.71 SLC6A4 (0.41) SLC6A4SLC6A3SLC6A2CYP2C19ALDH1A1
SCHEMBL5366545 0.71 CCR3 (0.47) ALDH1A1OPRM1OPRL1OPRK1
SCHEMBL5369330 0.69 SLC6A9 (0.38) SLC6A4SLC6A3SLC6A2OPRM1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225331-A1 4,4-Disubstituted piperidines, and methods of use thereof SEPRACOR INC. (US) 2007-09-27 US disclosed
US-7217823-B2 4,4-Disubstituted piperidines, and methods of use thereof SEPRACOR INC. (US) 2007-05-15 US disclosed
US-20040142974-A1 4,4-disubstituted piperidines, and methods of use thereof HOEMANN MICHAEL Z (US) 2004-07-22 US disclosed
US-6656953-B2 Ligands for receptors such as dopamine, serotonin, or norepinephrine transporters; broad uses claimed, such as pain reliever and antidepressant SEPRACOR INC. 2003-12-02 US disclosed
US-20020177607-A1 4,4-Disubstitued piperidines, and methods of use thereof SEPRACOR INC. 2002-11-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020177607-A1 4,4-Disubstitued piperidines, and methods of use thereof HTR2C, HTR5A, OPRL1 SLC6A4 10/4885SLC6A3 4/4885SLC6A2 14/4885
US-20070225331-A1 4,4-Disubstituted piperidines, and methods of use thereof HTR5A, HTR2C, OPRL1 SLC6A4 11/4885SLC6A3 5/4885SLC6A2 14/4885
US-20040142974-A1 4,4-disubstituted piperidines, and methods of use thereof HTR5A, HTR2C, OPRL1 SLC6A4 11/4885SLC6A3 5/4885SLC6A2 14/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.