SCHEMBL6922573

SCHEMBL6922573

Cc1c(Cl)cccc1Oc1ccccc1CC1CCNCC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 2/20 0.41
GBA1 P04062 1/20 0.41
SLC6A4 P31645 9/20 0.41
SLC6A2 P23975 8/20 0.40
HTR1A P08908 8/20 0.40
SLC6A3 Q01959 7/20 0.40
GNAI3 P08754 1/20 0.39
ADRA2A P08913 4/20 0.39
ADRA2B P18089 4/20 0.39
ADRA2C P18825 4/20 0.39
KCNH2 Q12809 2/20 0.39
NR1I2 O75469 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL6923981 0.85 HTR1A (0.48) HTR6GBA1SLC6A4SLC6A2HTR1A
SCHEMBL6922580 0.81 GBA1 (0.47) HTR6GBA1SLC6A4SLC6A2HTR1A
SCHEMBL6929202 0.80 HTR2C (0.52) GBA1SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL6927391 0.79 SLC6A4 (0.48) GBA1SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL4702823 0.77 HTR1A (0.60) HTR6SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL3161884 0.77 GBA1 (0.56) GBA1SLC6A4SLC6A2SLC6A3
SCHEMBL6927951 0.77 SLC6A4 (0.63) HTR6GBA1SLC6A4SLC6A2HTR1A
SCHEMBL6922684 0.77 SLC6A4 (0.53) GBA1SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL6926480 0.77 HTR1A (0.58) GBA1SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL7526768 0.76 SLC6A4 (0.56) GBA1SLC6A4SLC6A2HTR1ASLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6518284-B2 For inhibiting the serotonin and/or noradrenaline reuptake, and are useful as medicaments in disorders in which an increase of levels of those neurotransmitters is necessary FAES, FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS S.A. (ES) 2003-02-11 US claimed
US-20020038031-A1 New 4 - substituted piperidines ORJALES VENERO AURELIO (ES) 2002-03-28 US claimed
EP-1002794-A1 4-[(Aryl)(aryloxy)methyl]piperidine derivatives and their use as serotonin and/or noradrenaline reuptake inhibitors FAES, Fabrica Espanola de Productos Quimicos y Farmaceuticos, S.A. (ES) 2000-05-24 EP claimed

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

For each of this compound's patents that has machine-readable text (1 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-20020038031-A1 New 4 - substituted piperidines ADRA2C, ADRB2, ADRB1 HTR6 48/4885GBA1 1368/4885SLC6A4 11/4885

“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.