SCHEMBL6085553

SCHEMBL6085553

CN(Cc1ccccc1)CC1CCCC1c1ccc2[nH]cc(C#N)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 20/20 1.00
SLC6A2 P23975 4/20 0.74
SLC6A3 Q01959 3/20 0.63

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
SCHEMBL6085557 1.00 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083404 0.87 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083415 0.87 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083939 0.86 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6084533 0.86 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083930 0.86 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6084157 0.82 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6084167 0.82 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083844 0.81 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6083853 0.81 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3

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-20040063768-A1 Compounds for the treatment of premature ejaculation BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 US claimed
US-7105516-B2 Compounds for the treatment of premature ejaculation BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-12 US disclosed
US-20040063768-A1 Compounds for the treatment of premature ejaculation BRISTOL-MYERS SQUIBB COMPANY 2004-04-01 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 (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-20040063768-A1 Compounds for the treatment of premature ejaculation HTR5A, SLC18A2, CYP17A1 SLC6A4 12/4885SLC6A2 30/4885SLC6A3 6/4885

“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.