SCHEMBL3558200

SCHEMBL3558200

N#Cc1ccccc1S(=O)(=O)Nc1ccccc1OCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 9/20 0.48
PKM P14618 1/20 0.47
SLC40A1 Q9NP59 1/20 0.46
HRH2 P25021 1/20 0.45
HRH1 P35367 1/20 0.45
RAD52 P43351 1/20 0.44
CACNA1H O95180 1/20 0.43
CACNA1B Q00975 1/20 0.43
LPAR1 Q92633 1/20 0.42
LPAR5 Q9H1C0 1/20 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
SCHEMBL3553957 0.87 TSHR (0.53) SLC16A3PKMHRH2HRH1
SCHEMBL3556624 0.85 ALDH1A1 (0.51) PKMRAD52
SCHEMBL3563478 0.84 SLC16A3 (0.60) SLC16A3PKMRAD52
SCHEMBL3565992 0.84 PKM (0.50) PKMHRH2HRH1RAD52CACNA1H
SCHEMBL3554494 0.82 PKM (0.56) SLC16A3PKMCACNA1HCACNA1B
SCHEMBL3554984 0.82 PKM (0.56) SLC16A3PKMCACNA1HCACNA1B
SCHEMBL3563709 0.81 MEN1 (0.57) PKMSLC40A1RAD52
SCHEMBL3563311 0.81 ALDH1A1 (0.53)
SCHEMBL3558810 0.81 MRGPRX1 (0.51) PKMSLC40A1RAD52CACNA1HCACNA1B
SCHEMBL3564784 0.81 SLC16A3 (0.64) SLC16A3SLC40A1

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 425/4885PKM 990/4885SLC40A1 1414/4885

“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.