SCHEMBL6677206

SCHEMBL6677206

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.40
STAT3 P40763 11/20 0.39
RORC P51449 1/20 0.38
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
KMT2A Q03164 1/20 0.35
RELA Q04206 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
F10 P00742 1/20 0.34
PLG P00747 1/20 0.34
PLAU P00749 1/20 0.34
ST14 Q9Y5Y6 1/20 0.34
STAT5B P51692 1/20 0.34

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
SCHEMBL6681880 0.84 ACACB (0.38) F2STAT3RORCSTAT5B
SCHEMBL6676569 0.81 CA2 (0.38) LMNAKDM4ECA2
SCHEMBL6679407 0.81 SLC6A2 (0.43) ALDH1A1LMNAMAPTHTTKDM4E
SCHEMBL6680729 0.80 ADRB3 (0.49) SMN1; SMN2
SCHEMBL6680724 0.80 ADRB3 (0.49) SMN1; SMN2
SCHEMBL6676486 0.80 SLC6A4 (0.46) ALDH1A1LMNAHTTKDM4ESMN1; SMN2
SCHEMBL6804926 0.79 CA2 (0.36) LMNAMAPTKDM4EMEN1KMT2A
SCHEMBL6680578 0.79 HPGD (0.42) ALDH1A1LMNAMAPTKDM4EMEN1
SCHEMBL6682518 0.77 MMP2 (0.43) ALDH1A1LMNAHTTTDP1SMN1; SMN2
SCHEMBL6677650 0.76 CA2 (0.41) LMNAMAPTKDM4ECA2

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 F2 1701/4885STAT3 4193/4885RORC 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.