SCHEMBL6546110

SCHEMBL6546110

[CH2]CN(CCC)S(=O)(=O)CCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.42
CA1 P00915 2/20 0.41
CNR2 P34972 1/20 0.40
CA2 P00918 7/20 0.39
CA12 O43570 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CES1 P23141 4/20 0.33
CES2 O00748 1/20 0.33

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
SCHEMBL6546991 1.00 FAAH (0.42) FAAHCA1CNR2CA2CA12
SCHEMBL6546923 0.98 CA1 (0.43) FAAHCA1CNR2CA2CA12
SCHEMBL6546400 0.92 CA1 (0.44) FAAHCA1CNR2CA2CA12
SCHEMBL7864572 0.88 FAAH (0.48) FAAHCA1CNR2CA2CA12
SCHEMBL27905197 0.86 CA1 (0.50) FAAHCA1CNR2CA2CA12
SCHEMBL6546429 0.85 CA1 (0.41) FAAHCA1CNR2CA2CA12
SCHEMBL14229342 0.84 CNR2 (0.45) FAAHCA1CNR2CA2CA12
SCHEMBL14229917 0.84 CNR2 (0.45) FAAHCA1CNR2CA2CA12
SCHEMBL6546815 0.84 CNR2 (0.42) FAAHCA1CNR2CA2CA12
SCHEMBL6546381 0.84 FAAH (0.40) FAAHCNR2CA2CES1CES2

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-1379238-A1 FAVORABLE MODULATION OF HEALTH-RELATED QUALITY OF LIFE AND HEALTH-RELATED QUALITY-ADJUSTED TIME-TO-PROGRESSION OF DISEASE IN PATIENTS WITH PROSTATE CANCER Abbott Laboratories (US) 2004-01-14 EP disclosed
US-20030092757-A1 Favorable modulation of health-related quality of life and health-related quality-adjusted time-to-progression of disease in patients with prostate cancer ABBOTT LABORATORIES 2003-05-15 US disclosed
WO-2002085351-A1 FAVORABLE MODULATION OF HEALTH-RELATED QUALITY OF LIFE AND HEALTH-RELATED QUALITY-ADJUSTED TIME-TO-PROGRESSION OF DISEASE IN PATIENTS WITH PROSTATE CANCER ABBOTT LABORATORIES (US) 2002-10-31 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-20030092757-A1 Favorable modulation of health-related quality of life and health-related quality-adjusted time-to-progression of disease in patients with prostate cancer KLK3, ACP3, BPHL FAAH 1986/4885CA1 4501/4885CNR2 4456/4885

“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.