SCHEMBL3565016

SCHEMBL3565016

O=C(O)c1ccc(CCc2cccc(NS(=O)(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
IDH1 O75874 3/20 0.52
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GAA P10253 1/20 0.48
PPARG P37231 1/20 0.48
HTR6 P50406 4/20 0.47
SERPINE1 P05121 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
CPT2 P23786 1/20 0.46
CPT1A P50416 1/20 0.46
CPT1B Q92523 1/20 0.46
AKR1C3 P42330 1/20 0.45
AKR1C2 P52895 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL3555136 0.92 MAPT (0.59) MAPTIDH1MEN1KMT2ALMNA
SCHEMBL3556854 0.92 MAPT (0.53) MAPTIDH1MEN1KMT2AHTT
SCHEMBL3556578 0.90 PSEN1 (0.52) MAPTIDH1MEN1KMT2AGAA
SCHEMBL3564979 0.89 SERPINE1 (0.51) MAPTIDH1MEN1KMT2AGAA
SCHEMBL3555871 0.86 POLB (0.60) MAPTMEN1KMT2AHTR6POLB
SCHEMBL3555628 0.85 HTR6 (0.65) MEN1KMT2AHTR6AKR1C3POLB
SCHEMBL3553439 0.84 GAA (0.62) MAPTIDH1MEN1KMT2ALMNA
SCHEMBL3558864 0.84 NR3C1 (0.59) MAPTIDH1MEN1KMT2ALMNA
SCHEMBL3561240 0.84 KMT2A (0.51) MAPTIDH1MEN1KMT2ALMNA
SCHEMBL3562289 0.83 MAPT (0.61) MAPTIDH1MEN1KMT2ALMNA

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 MAPT 4130/4885IDH1 970/4885MEN1 2548/4885

“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.