SCHEMBL3560804

SCHEMBL3560804

CCCC(Nc1ccccc1CCc1ccc(C(=O)O)cc1)S(=O)(=O)c1ccc(NC(C)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 2/20 0.46
ALDH1A1 P00352 6/20 0.45
KMT2A Q03164 6/20 0.45
MEN1 O00255 4/20 0.45
MAPT P10636 2/20 0.45
USP2 O75604 1/20 0.45
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GAA P10253 1/20 0.41
EGFR P00533 1/20 0.39
HTT P42858 1/20 0.39
BDKRB1 P46663 1/20 0.39
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
CNR2 P34972 1/20 0.39
CYP2C9 P11712 1/20 0.38

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
SCHEMBL3561601 0.91 SLC16A3 (0.49) SLC16A3KMT2AMEN1MAPTGAA
SCHEMBL3560872 0.90 SLC16A3 (0.50) SLC16A3
SCHEMBL3557115 0.84 SLC16A3 (0.48) SLC16A3KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL3553932 0.83 SLC16A3 (0.46) SLC16A3ALDH1A1KMT2AMEN1MAPT
SCHEMBL3557951 0.83 SLC16A3 (0.48) SLC16A3ALDH1A1KMT2AMEN1MAPT
SCHEMBL3555276 0.83 SLC16A3 (0.47) SLC16A3ALDH1A1KMT2AMEN1MAPT
SCHEMBL3552964 0.81 SLC16A3 (0.46) SLC16A3ALDH1A1KMT2AMEN1MAPT
SCHEMBL3556564 0.81 SLC16A3 (0.47) SLC16A3ALDH1A1KMT2AMEN1MAPT
SCHEMBL3557890 0.81 SLC16A3 (0.46) SLC16A3
SCHEMBL3554705 0.80 SLC16A3 (0.67) SLC16A3ALDH1A1KMT2AMEN1KDM4E

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 425/4885ALDH1A1 61/4885KMT2A 4045/4885

“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.