SCHEMBL6677068

SCHEMBL6677068

CCOC(=O)c1cc(Oc2ccccc2)ccc1S(=O)(=O)c1ccc(C[C@@H](C)NC(=O)C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.42
ACACB O00763 3/20 0.42
MMP2 P08253 9/20 0.40
MMP13 P45452 9/20 0.40
MMP3 P08254 2/20 0.40
MMP9 P14780 2/20 0.40
MMP8 P22894 2/20 0.40
MMP12 P39900 2/20 0.40
MMP14 P50281 2/20 0.40
MMP16 P51512 2/20 0.40
MMP1 P03956 4/20 0.39
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.37
MME P08473 1/20 0.36

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
SCHEMBL6683466 0.90 CNR1 (0.46) CNR1ACACBMMP2MMP13MMP3
SCHEMBL6677304 0.90 CNR1 (0.54) CNR1ACACBALDH1A1LMNASMN1; SMN2
SCHEMBL6682350 0.88 CNR1 (0.40) CNR1ACACBMMP2MMP13MMP3
SCHEMBL6805221 0.85 ACACB (0.48) CNR1ACACBALDH1A1LMNASMN1; SMN2
SCHEMBL6809808 0.85 CNR1 (0.41) CNR1ACACBGAA
SCHEMBL6677333 0.85 CNR1 (0.46) CNR1ACACBALDH1A1LMNAGAA
SCHEMBL6676664 0.85 CNR1 (0.41) CNR1ACACBLMNASMN1; SMN2GAA
SCHEMBL6682518 0.84 MMP2 (0.43) MMP2MMP13MMP3MMP9MMP8
SCHEMBL6800370 0.83 CNR1 (0.44) CNR1ACACBMMP2MMP13MMP3
SCHEMBL6803630 0.83 CNR1 (0.40) CNR1ACACBSMN1; SMN2GAA

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 CNR1 112/4885ACACB 1800/4885MMP2 3633/4885

“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.