SCHEMBL1697227

SCHEMBL1697227

OCC(c1ccccc1)C1CCNCC1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.59
SLC6A4 P31645 6/20 0.59
SLC6A3 Q01959 6/20 0.59
SOS1 Q07889 1/20 0.45
OPRD1 P41143 1/20 0.45
CACNA2D1 P54289 1/20 0.44
CACNA1B Q00975 1/20 0.44
CACNB1 Q02641 1/20 0.44

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
SCHEMBL7547844 0.90 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
SCHEMBL25324799 0.87 FFAR1 (0.51) SLC6A2SLC6A4SLC6A3
SCHEMBL7428096 0.83 MEN1 (0.55)
SCHEMBL16321856 0.83 SLC6A2 (0.68) SLC6A2SLC6A4SLC6A3
SCHEMBL93039 0.82 OPRD1 (0.48) SLC6A2SLC6A4SLC6A3SOS1OPRD1
SCHEMBL9381630 0.82 SOS1 (0.45) SLC6A2SLC6A4SLC6A3SOS1OPRD1
SCHEMBL966816 0.81 MEN1 (0.58)
Hydrochloric Acid SCHEMBL15535996 0.81 SLC6A2 (0.71) SLC6A2SLC6A4SLC6A3
SCHEMBL13476484 0.81 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3
SCHEMBL14095780 0.81 SLC6A4 (0.52) SLC6A2SLC6A4SLC6A3

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-20130131079-A1 FLUFENOXINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF AMYLOID PATHOLOGIES FAES FARMA, S.A. (ES) 2013-05-23 US disclosed
EP-2576509-A1 FLUFENOXINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF AMILOYD PATHOLOGIES Faes Farma, S.A. (ES) 2013-04-10 EP disclosed
CN-103025714-A Flufenoxine derivatives for the treatment and prevention of amiloyd pathologies FAES FARMA SA 2013-04-03 CN disclosed
WO-2011147780-A1 FLUFENOXINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF AMILOYD PATHOLOGIES FAES FARMA, S.A. (ES) 2011-12-01 WO disclosed
EP-2390248-A1 Flufenoxine derivatives for the treatment and prevention of amiloyd pathologies FAES FARMA, S.A. (ES) 2011-11-30 EP 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 (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-20130131079-A1 FLUFENOXINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF AMYLOID PATHOLOGIES APP, MAPT, PSEN1 SLC6A2 173/4885SLC6A4 325/4885SLC6A3 617/4885

“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.