SCHEMBL4335645

SCHEMBL4335645

N#Cc1ccc(-c2ccc(Sc3cccc(F)c3)c(OCCN3CCCC3C(=O)O)c2)cc1

nearest known ligand 0.85

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 13/20 0.85
HSD11B1 P28845 1/20 0.39
PTGER4 P35408 2/20 0.38
HRH3 Q9Y5N1 2/20 0.38
GYS1 P13807 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
SCHEMBL4335638 1.00 SLC6A9 (0.85) SLC6A9HSD11B1PTGER4HRH3GYS1
Hydrochloric Acid SCHEMBL4349411 0.99 SLC6A9 (0.83) SLC6A9HSD11B1PTGER4HRH3GYS1
Hydrochloric Acid SCHEMBL4349418 0.99 SLC6A9 (0.83) SLC6A9HSD11B1PTGER4HRH3GYS1
SCHEMBL4344586 0.95 SLC6A9 (0.84) SLC6A9HSD11B1PTGER4HRH3
SCHEMBL4344591 0.95 SLC6A9 (0.84) SLC6A9HSD11B1PTGER4HRH3
Hydrochloric Acid SCHEMBL4342642 0.94 SLC6A9 (0.83) SLC6A9HSD11B1PTGER4HRH3
Hydrochloric Acid SCHEMBL4342638 0.94 SLC6A9 (0.83) SLC6A9HSD11B1PTGER4HRH3
SCHEMBL4340340 0.89 SLC6A9 (0.77) SLC6A9PTGER4
SCHEMBL4340348 0.89 SLC6A9 (0.77) SLC6A9PTGER4
SCHEMBL4338281 0.87 SLC6A9 (1.00) SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612068-B2 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2009-11-03 US claimed
US-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2006-10-19 US claimed
US-7612068-B2 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2009-11-03 US disclosed
US-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives H. LUNDBECK A/S (DK) 2006-10-19 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-20060235003-A1 Aromatic oxyphenyl and aromatic sulfanylphenyl derivatives TYR, TPST2, COMT SLC6A9 2305/4885HSD11B1 790/4885PTGER4 1649/4885

“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.