SCHEMBL6209826

SCHEMBL6209826

O=CNCC1(c2ccc(-c3ccc(F)cc3)cc2)CCCC1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 11/20 0.58
SLC6A4 P31645 10/20 0.58
HSD11B1 P28845 2/20 0.49
SLC6A2 P23975 5/20 0.48
CACNA1G O43497 4/20 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
SCHEMBL6240339 0.98 SLC6A3 (0.60) SLC6A3SLC6A4HSD11B1SLC6A2CACNA1G
SCHEMBL6208716 0.86 SLC6A4 (0.65) SLC6A3SLC6A4SLC6A2
SCHEMBL6492041 0.84 SLC6A4 (0.68) SLC6A3SLC6A4SLC6A2
SCHEMBL6231738 0.84 SLC6A3 (0.61) SLC6A3SLC6A4SLC6A2
SCHEMBL6494934 0.82 SLC6A4 (0.63) SLC6A3SLC6A4SLC6A2
SCHEMBL6209359 0.79 LMNA (0.51) SLC6A3SLC6A4SLC6A2
SCHEMBL6208320 0.78 LMNA (0.50) SLC6A3SLC6A4SLC6A2
SCHEMBL7573036 0.75 SOAT2 (0.51) SLC6A3SLC6A4SLC6A2
SCHEMBL17832228 0.75 SLC6A4 (0.96) SLC6A3SLC6A4HSD11B1SLC6A2
SCHEMBL3518031 0.73 SLC6A4 (1.00) SLC6A3SLC6A4HSD11B1SLC6A2

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-20050234096-A1 Tetrahydroisoquinoline derivatives BAYER HEALTHCARE AG (DE) 2005-10-20 US disclosed
EP-1507763-A1 TETRAHYDROISOQUINOLINE DERIVATIVES Bayer HealthCare AG (DE) 2005-02-23 EP disclosed
WO-2003097607-A1 TETRAHYDROISOQUINOLINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2003-11-27 WO 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-20050234096-A1 Tetrahydroisoquinoline derivatives PPARD, PPARG, PPARA SLC6A3 3645/4885SLC6A4 3525/4885HSD11B1 213/4885

“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.