SCHEMBL3564095

SCHEMBL3564095

O=C(O)c1ccccc1CCc1cccc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
IDH1 O75874 2/20 0.54
SLC16A3 O15427 1/20 0.53
KMT2A Q03164 3/20 0.52
NPSR1 Q6W5P4 2/20 0.52
LMNA P02545 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ACLY P53396 1/20 0.51
HTR6 P50406 3/20 0.50
ERAP1 Q9NZ08 1/20 0.49
AR P10275 1/20 0.49
IKBKB O14920 1/20 0.49
MEN1 O00255 2/20 0.48
HTT P42858 1/20 0.48
GPR27 Q9NS67 2/20 0.48
AVPR2 P30518 1/20 0.48
KDM1A O60341 1/20 0.48
GAA P10253 1/20 0.48
PPARG P37231 1/20 0.48

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
SCHEMBL3561240 0.92 KMT2A (0.51) MAPTIDH1SLC16A3KMT2ANPSR1
SCHEMBL3556741 0.90 IKBKB (0.64) MAPTIDH1SLC16A3KMT2ANPSR1
SCHEMBL3561338 0.89 HTR6 (0.62) MAPTSLC16A3HTR6
SCHEMBL3556257 0.88 SLC16A3 (0.67) MAPTSLC16A3KMT2ALMNAHTR6
SCHEMBL3552616 0.88 AR (0.55) MAPTKMT2AACLYHTR6AR
SCHEMBL3562289 0.87 MAPT (0.61) MAPTIDH1SLC16A3KMT2ANPSR1
SCHEMBL3551639 0.87 SLC16A3 (0.59) MAPTSLC16A3KMT2AHTR6MEN1
SCHEMBL3555450 0.87 IKBKB (0.52) MAPTIDH1SLC16A3HTR6IKBKB
SCHEMBL3563721 0.87 SERPINE1 (0.51) MAPTSLC16A3HTR6
SCHEMBL3554566 0.86 MAPT (0.60) MAPTSLC16A3KMT2AHTR6MEN1

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 970/4885SLC16A3 425/4885

“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.