SCHEMBL6498188

SCHEMBL6498188

COC(=O)C1=C(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)CCC1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.35
PRSS1 P07477 2/20 0.35
PRSS2 P07478 2/20 0.35
PRSS3 P35030 2/20 0.35
SLC6A3 Q01959 10/20 0.33
CA1 P00915 5/20 0.33
CA2 P00918 5/20 0.33
MMP1 P03956 5/20 0.33
MMP2 P08253 5/20 0.33
MMP9 P14780 5/20 0.33
MMP8 P22894 5/20 0.33
MMP13 P45452 5/20 0.33
SLC6A2 P23975 5/20 0.32
AKR1C3 P42330 1/20 0.30
SLC6A4 P31645 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL6503256 0.96 SLC6A2 (0.36) F2PRSS1PRSS2PRSS3SLC6A3
SCHEMBL502662 0.84 SLC6A3 (0.37) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL6492100 0.82 KDM4E (0.36) CA1CA2MMP1MMP2MMP9
SCHEMBL6492089 0.82 KDM4E (0.36) CA1CA2MMP1MMP2MMP9
SCHEMBL6665551 0.82 CA1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL4548472 0.81 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL1958265 0.80 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL15876290 0.75 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4ACHE
SCHEMBL1957632 0.69 ADORA1 (0.38) SLC6A3CA1CA2
SCHEMBL9269477 0.69 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4ACHE

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
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 US disclosed
EP-1472226-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-11-03 EP disclosed
WO-2003045921-A1 HETEROCYCLIC AMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-05 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 F2 62/4885PRSS1 387/4885PRSS2 596/4885

“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.