SCHEMBL3556776

SCHEMBL3556776

COc1ccc(OC)c(S(=O)(=O)Nc2cccc(CCc3cccc(C(=O)O)c3)c2)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
USP2 O75604 1/20 0.64
SMN1; SMN2 Q16637 4/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
FABP4 P15090 2/20 0.58
NPC1 O15118 1/20 0.58
SLC16A3 O15427 1/20 0.56
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX12 P18054 1/20 0.55
GAA P10253 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL3554579 0.93 L3MBTL1 (0.67) LMNAUSP2SMN1; SMN2L3MBTL1SLC16A3
SCHEMBL3558720 0.93 L3MBTL1 (0.61) LMNAUSP2SMN1; SMN2L3MBTL1FABP4
SCHEMBL3556994 0.88 MEN1 (0.61) LMNAUSP2SMN1; SMN2L3MBTL1FABP4
SCHEMBL3558727 0.86 SLC16A3 (0.76) SMN1; SMN2SLC16A3ALDH1A1MEN1KMT2A
SCHEMBL3551591 0.85 ALDH1A1 (0.65) LMNASMN1; SMN2SLC16A3ALDH1A1MEN1
SCHEMBL3562818 0.84 AKR1C3 (0.66) LMNASMN1; SMN2SLC16A3ALDH1A1MEN1
SCHEMBL3560246 0.83 SLC16A3 (0.69) SMN1; SMN2L3MBTL1SLC16A3ALDH1A1MEN1
SCHEMBL3553801 0.83 HTT (0.61) LMNAUSP2SMN1; SMN2FABP4NPC1
SCHEMBL3559723 0.83 L3MBTL1 (0.73) LMNASMN1; SMN2L3MBTL1FABP4ALDH1A1
SCHEMBL9886550 0.80 HSD11B1 (0.60) LMNASMN1; SMN2ALDH1A1MEN1KMT2A

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 LMNA 2120/4885USP2 3126/4885SMN1; SMN2 4522/4885

“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.