SCHEMBL3562744

SCHEMBL3562744

N#Cc1ccccc1S(=O)(=O)CCCCCCCNc1ccccc1CCc1ccc(C(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC16A3 O15427 8/20 0.47
TAS2R14 Q9NYV8 2/20 0.40
HDAC1 Q13547 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
XDH P47989 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
FFAR1 O14842 1/20 0.34
AR P10275 1/20 0.34
METAP2 P50579 1/20 0.34

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
SCHEMBL3553582 0.85 SLC16A3 (0.49) SLC16A3TAS2R14HDAC1HDAC8L3MBTL1
SCHEMBL3555272 0.84 HDAC1 (0.52) SLC16A3TAS2R14HDAC1HDAC8L3MBTL1
SCHEMBL3560868 0.83 HDAC1 (0.53) SLC16A3TAS2R14HDAC1HDAC8L3MBTL1
SCHEMBL3561332 0.80 SLC16A3 (0.44) SLC16A3HDAC1HDAC8ALDH1A1HPGD
SCHEMBL3558213 0.80 SLC16A3 (0.44) SLC16A3TAS2R14HDAC1HDAC8POLB
SCHEMBL3563137 0.80 SLC16A3 (0.71) SLC16A3TAS2R14HDAC1
SCHEMBL3555112 0.80 SLC16A3 (0.47) SLC16A3TAS2R14HDAC1HDAC8L3MBTL1
SCHEMBL3552967 0.80 SLC16A3 (0.49) SLC16A3TAS2R14HDAC1HDAC8ALDH1A1
SCHEMBL3556567 0.80 SLC16A3 (0.51) SLC16A3TAS2R14HDAC1HDAC8HSD17B10
SCHEMBL3553935 0.80 SLC16A3 (0.49) SLC16A3TAS2R14HDAC1HDAC8HSD17B10

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 425/4885TAS2R14 3203/4885HDAC1 1894/4885

“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.