SCHEMBL6153033

SCHEMBL6153033

CSc1ccc(Oc2ccc(NS(C)(=O)=O)cc2C#N)cc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.66
PLA2G7 Q13093 11/20 0.51
PTGS2 P35354 1/20 0.49
PGR P06401 1/20 0.47
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CYP3A4 P08684 1/20 0.44
PPARG P37231 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
SCHEMBL6151338 0.80 SLC6A4 (1.00) SLC6A4SLC6A2SLC6A3
SCHEMBL6151642 0.78 SLC6A4 (0.77) SLC6A4PTGS2SLC6A2SLC6A3
SCHEMBL6863684 0.77 ALDH1A1 (0.60) PLA2G7PGR
SCHEMBL6151699 0.77 SLC6A4 (0.46) SLC6A4PLA2G7PTGS2SLC6A2SLC6A3
SCHEMBL6152088 0.75 KDM4E (0.55) SLC6A4SLC6A2SLC6A3CYP3A4
SCHEMBL13065706 0.73 SLC22A12 (0.43) PGR
SCHEMBL6153036 0.72 VCAM1 (0.47) PLA2G7
SCHEMBL20510870 0.72 CYP19A1 (0.50) SLC6A4
SCHEMBL30360758 0.72 CYP19A1 (0.50) SLC6A4
SCHEMBL6152010 0.72 SLC6A4 (0.47) SLC6A4PLA2G7PTGS2SLC6A2SLC6A3

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
EP-1268396-B1 DIPHENYL ETHER COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2005-07-20 EP disclosed
US-6448293-B1 TREATMENT OR PREVENTION OF A DISORDER IN WHICH THE REGULATION OF MONOAMINE TRANSPORTER FUNCTION IS IMPLICATED, SUCH AS PREMATURE EJACULATION. PFIZER INC. 2002-09-10 US disclosed
US-20020052395-A1 Diphenyl ether compounds useful in therapy ANDREWS MARK DAVID (GB) 2002-05-02 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-20020052395-A1 Diphenyl ether compounds useful in therapy CBR1, OGFR, CBR3 SLC6A4 2002/4885PLA2G7 4077/4885PTGS2 2397/4885

“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.