SCHEMBL6929938

SCHEMBL6929938

Fc1cccc(Oc2ccc(CC3CCNCC3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.52
SLC6A2 P23975 6/20 0.52
SLC6A3 Q01959 5/20 0.52
HTR1A P08908 4/20 0.52
GBA1 P04062 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
HTR6 P50406 1/20 0.44
KCNH2 Q12809 1/20 0.44
SCN3A Q9NY46 1/20 0.44
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP9 P14780 1/20 0.43
MMP14 P50281 1/20 0.43

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
SCHEMBL6928734 0.87 GBA1 (0.50) SLC6A4SLC6A2SLC6A3HTR1AGBA1
SCHEMBL6922681 0.86 GBA1 (0.54) SLC6A4SLC6A2SLC6A3HTR1AGBA1
SCHEMBL6928127 0.85 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3HTR1AGBA1
SCHEMBL7526770 0.84 GBA1 (0.71) SLC6A4SLC6A2SLC6A3HTR1AGBA1
SCHEMBL6925834 0.84 GBA1 (0.50) SLC6A4SLC6A2SLC6A3GBA1KCNH2
SCHEMBL6930124 0.84 GBA1 (0.50) SLC6A4SLC6A2SLC6A3GBA1HTR2C
SCHEMBL6927955 0.84 SLC6A2 (0.52) SLC6A4SLC6A2SLC6A3HTR1AGBA1
SCHEMBL12420566 0.82 MAOB (0.58) GBA1HTR6KCNH2
SCHEMBL6930302 0.82 TDP1 (0.45) SLC6A4SLC6A2SLC6A3GBA1
SCHEMBL6927185 0.82 MGLL (0.50) SLC6A4SLC6A2SLC6A3GBA1HTR6

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 SLC6A4 11/4885SLC6A2 12/4885SLC6A3 31/4885

“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.