SCHEMBL3558355

SCHEMBL3558355

O=C(O)c1cccc(CCc2ccccc2NS(=O)(=O)c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.79

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 8/20 0.79
ACLY P53396 1/20 0.51
MAPT P10636 1/20 0.49
KDM1A O60341 1/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP19A1 P11511 1/20 0.48
RAB9A P51151 1/20 0.48
MRGPRX4 Q96LA9 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL3553876 0.94 SLC16A3 (0.70) SLC16A3ACLYMAPTKDM1AMEN1
SCHEMBL3560831 0.92 SLC16A3 (0.72) SLC16A3ACLYMEN1GAAKMT2A
SCHEMBL3553475 0.91 SLC16A3 (0.71) SLC16A3ACLYMEN1GAAKMT2A
SCHEMBL3564986 0.90 SLC16A3 (0.76) SLC16A3MAPTGAARAB9A
SCHEMBL3565044 0.89 SLC16A3 (0.85) SLC16A3MEN1KMT2ARAB9APOLB
SCHEMBL3552744 0.89 SLC16A3 (0.85) SLC16A3MEN1KMT2ARAB9A
SCHEMBL3554617 0.88 SLC16A3 (0.68) SLC16A3ACLYMAPTKDM1AMEN1
SCHEMBL3561340 0.88 SLC16A3 (1.00) SLC16A3MEN1KMT2ARAB9A
SCHEMBL3553695 0.87 SLC16A3 (0.82) SLC16A3ACLYMAPTMEN1GAA
SCHEMBL3560300 0.87 SLC16A3 (0.74) SLC16A3MEN1KMT2ARAB9AMRGPRX4

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 SLC16A3 425/4885ACLY 586/4885MAPT 4130/4885

“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.