SCHEMBL6681880

SCHEMBL6681880

CCOC(=O)c1cc(C2CCCCC2)ccc1S(=O)(=O)c1ccc(C[C@@H](C)NC(=O)C(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 6/20 0.38
CNR1 P21554 3/20 0.38
RORC P51449 1/20 0.35
STAT3 P40763 8/20 0.35
F2 P00734 1/20 0.34
KDM1A O60341 1/20 0.34
STAT5B P51692 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
SCHEMBL6683292 0.87 CNR1 (0.35) ACACBCNR1
SCHEMBL6677206 0.84 F2 (0.40) RORCSTAT3F2STAT5B
SCHEMBL6809808 0.84 CNR1 (0.41) ACACBCNR1
SCHEMBL6676664 0.84 CNR1 (0.41) ACACBCNR1
SCHEMBL6677333 0.84 CNR1 (0.46) ACACBCNR1
SCHEMBL6677304 0.83 CNR1 (0.54) ACACBCNR1
SCHEMBL6803630 0.82 CNR1 (0.40) ACACBCNR1
SCHEMBL6682350 0.81 CNR1 (0.40) ACACBCNR1
SCHEMBL6678316 0.81 CNR1 (0.40) ACACBCNR1
SCHEMBL6804512 0.81 CNR1 (0.39) ACACBCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106653-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-03 US disclosed
WO-2004045610-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD (JP) 2004-06-03 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-20040106653-A1 Aminoalcohol derivatives FANCD2, FANCI, HRH2 ACACB 1800/4885CNR1 112/4885RORC 4175/4885

“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.