SCHEMBL3562226

SCHEMBL3562226

CCc1ccc(S(=O)(=O)Nc2cccc(CCc3ccccc3C(=O)O)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
HTR6 P50406 5/20 0.53
METAP2 P50579 4/20 0.52
SLC16A3 O15427 2/20 0.52
LIMK2 P53671 1/20 0.49
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48
POLB P06746 1/20 0.47
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN5 P54829 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL3562892 0.93 METAP2 (0.57) ALDH1A1HTR6METAP2SLC16A3KEAP1
SCHEMBL3561338 0.91 HTR6 (0.62) ALDH1A1HTR6METAP2SLC16A3KEAP1
SCHEMBL3565938 0.91 METAP2 (0.59) HTR6METAP2SLC16A3LIMK2KEAP1
SCHEMBL3556527 0.90 ALDH1A1 (0.56) ALDH1A1HTR6SLC16A3LIMK2KEAP1
SCHEMBL3551639 0.89 SLC16A3 (0.59) HTR6SLC16A3LIMK2KEAP1NFE2L2
SCHEMBL3557166 0.89 ALDH1A1 (0.60) ALDH1A1HTR6METAP2LIMK2PTPN2
SCHEMBL3555114 0.88 CA12 (0.58) HTR6SLC16A3LIMK2KEAP1NFE2L2
SCHEMBL3556257 0.88 SLC16A3 (0.67) ALDH1A1HTR6METAP2SLC16A3LIMK2
SCHEMBL3554566 0.88 MAPT (0.60) ALDH1A1HTR6SLC16A3LIMK2KEAP1
SCHEMBL3561071 0.87 HTR6 (0.51) HTR6SLC16A3KEAP1NFE2L2POLB

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 ALDH1A1 61/4885HTR6 2387/4885METAP2 2438/4885

“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.