SCHEMBL3555895

SCHEMBL3555895

CCc1ccc(S(=O)(=O)Nc2cccc(CCc3cccc(C(=O)O)c3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.61
ALDH1A1 P00352 2/20 0.57
SLC16A3 O15427 2/20 0.55
HTR6 P50406 4/20 0.54
LIMK2 P53671 1/20 0.53
PFKFB3 Q16875 1/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MAPT P10636 2/20 0.51
WDR5 P61964 1/20 0.51
TCF4 P15884 1/20 0.50
CTNNB1 P35222 1/20 0.50
PKM P14618 1/20 0.49

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
SCHEMBL3561244 0.93 ALDH1A1 (0.57) POLBALDH1A1HTR6LIMK2MEN1
SCHEMBL3555180 0.93 ALDH1A1 (0.57) POLBALDH1A1SLC16A3LIMK2MEN1
SCHEMBL3558114 0.90 POLB (0.67) POLBALDH1A1SLC16A3HTR6PFKFB3
SCHEMBL3553788 0.90 POLB (0.57) POLBSLC16A3HTR6LIMK2WDR5
SCHEMBL3562390 0.89 POLB (0.62) POLBALDH1A1SLC16A3HTR6LIMK2
SCHEMBL3553555 0.89 HTR6 (0.67) POLBSLC16A3HTR6PFKFB3MEN1
SCHEMBL3558666 0.88 CA12 (0.61) POLBALDH1A1SLC16A3HTR6PFKFB3
SCHEMBL3555622 0.87 SLC16A3 (0.72) POLBALDH1A1SLC16A3HTR6LIMK2
SCHEMBL3564982 0.87 POLB (0.74) POLBALDH1A1SLC16A3HTR6PFKFB3
SCHEMBL3560463 0.87 POLB (0.62) POLBSLC16A3HTR6LIMK2MEN1

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 POLB 3962/4885ALDH1A1 61/4885SLC16A3 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.