SCHEMBL3556205

SCHEMBL3556205

Cc1cccc(S(=O)(=O)Nc2ccc(OCCOc3ccc(C(=O)O)cc3)cc2)c1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
ALDH1A1 P00352 2/20 0.64
HPGD P15428 1/20 0.64
KMT2A Q03164 8/20 0.60
MEN1 O00255 6/20 0.60
WDR5 P61964 2/20 0.58
GFER P55789 1/20 0.58
FABP4 P15090 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC8 Q9BY41 1/20 0.51

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
SCHEMBL3561961 0.87 PGR (0.65) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL3563809 0.86 MEN1 (0.62) MAPTKMT2AMEN1WDR5GFER
SCHEMBL3556446 0.86 PGR (0.62) MAPTALDH1A1KMT2AMEN1WDR5
SCHEMBL3562602 0.86 ALDH1A1 (0.53) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL3562684 0.86 SLC16A3 (0.50) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL3555882 0.85 GFER (0.79) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL3553349 0.84 ALDH1A1 (0.68) MAPTALDH1A1HPGDKMT2AMEN1
SCHEMBL3562573 0.83 AR (0.65) KMT2AMEN1WDR5HDAC1HDAC8
SCHEMBL3564900 0.82 ALDH1A1 (0.64) MAPTALDH1A1KMT2AMEN1WDR5
SCHEMBL3561363 0.82 MAPT (0.50) MAPTALDH1A1HPGDKMT2AMEN1

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 MAPT 4130/4885ALDH1A1 61/4885HPGD 389/4885

“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.