SCHEMBL3556313

SCHEMBL3556313

N#Cc1ccccc1S(=O)(=O)Nc1ccccc1CCCc1ccc(C(=O)O)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 12/20 0.64
SLC40A1 Q9NP59 1/20 0.45
TAS2R14 Q9NYV8 1/20 0.44
PTGER1 P34995 1/20 0.44
PTGER4 P35408 1/20 0.44
PTGER3 P43115 1/20 0.44
PTGER2 P43116 1/20 0.44
SLC22A12 Q96S37 2/20 0.42

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
SCHEMBL3563137 0.94 SLC16A3 (0.71) SLC16A3SLC40A1TAS2R14SLC22A12
SCHEMBL3553799 0.89 SLC16A3 (0.67) SLC16A3SLC40A1SLC22A12
SCHEMBL5162154 0.88 SLC16A3 (0.51) SLC16A3TAS2R14
SCHEMBL3551901 0.83 SLC16A3 (0.89) SLC16A3PTGER1PTGER4PTGER3PTGER2
SCHEMBL3556525 0.83 SLC16A3 (0.64) SLC16A3TAS2R14PTGER1PTGER4PTGER3
SCHEMBL3561556 0.83 SLC16A3 (0.74) SLC16A3SLC40A1
SCHEMBL3555752 0.83 TSHR (0.56) SLC16A3SLC22A12
SCHEMBL3557081 0.83 SLC16A3 (0.66) SLC16A3PTGER1PTGER4PTGER3PTGER2
SCHEMBL3556555 0.82 SLC16A3 (0.52) SLC16A3SLC40A1SLC22A12
SCHEMBL3566896 0.80 SLC16A3 (0.61) SLC16A3SLC40A1PTGER1PTGER4PTGER3

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 425/4885SLC40A1 1414/4885TAS2R14 3203/4885

“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.