SCHEMBL3562298

SCHEMBL3562298

O=C(O)c1ccccc1CCc1ccccc1NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
GAA P10253 1/20 0.62
ACLY P53396 9/20 0.53
SLC16A3 O15427 3/20 0.52
KDM1A O60341 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CCR1 P32246 2/20 0.46
CCR2 P41597 2/20 0.46

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
SCHEMBL3564184 0.89 ACLY (0.60) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3553504 0.87 MEN1 (0.73) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3553743 0.86 MEN1 (0.72) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3560831 0.86 SLC16A3 (0.72) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3564977 0.85 SLC16A3 (0.67) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3553456 0.85 MEN1 (0.50) MEN1KMT2AGAAACLY
SCHEMBL3561433 0.84 ACLY (0.56) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3556581 0.84 SLC16A3 (0.58) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3561240 0.84 KMT2A (0.51) MEN1KMT2AGAAACLYSLC16A3
SCHEMBL3559492 0.82 SLC16A3 (0.64) MEN1KMT2AGAAACLYSLC16A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US claimed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 US claimed
US-7816397-B2 Phenylcarboxylic acid derivatives and use thereof for the treatment of diabetes MERCK PATENT GMBH (DE) 2010-10-19 US disclosed
US-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes MERCK PATENT GMBH (DE) 2008-02-21 US 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-20080045483-A1 Phenylcarboxylic Acid Derivatives and Use Thereof for the Treatment of Diabetes SLC5A1, ALDH7A1, ASS1 MEN1 2548/4885KMT2A 4045/4885GAA 1191/4885

“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.