SCHEMBL3552082

SCHEMBL3552082

Cc1c(C)c(C)c(S(=O)(=O)Nc2ccc(CCc3cccc(C(=O)O)c3)cc2)c(C)c1C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
AKR1C3 P42330 3/20 0.48
SLC16A3 O15427 6/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 2/20 0.45
WDR5 P61964 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
GAA P10253 1/20 0.44
NR1I2 O75469 1/20 0.43

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
SCHEMBL3559952 0.91 ALDH1A1 (0.51) MEN1KMT2AAKR1C3SLC16A3ALDH1A1
SCHEMBL3558572 0.88 MAPT (0.56) MEN1KMT2AAKR1C3SLC16A3SMN1; SMN2
SCHEMBL3551155 0.88 HTR6 (0.46) MEN1KMT2AAKR1C3SMN1; SMN2ALDH1A1
SCHEMBL3563431 0.87 ALDH1A1 (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1CA1
SCHEMBL3552101 0.85 PKM (0.51) MEN1KMT2AAKR1C3SLC16A3CA1
SCHEMBL3554962 0.84 ALDH1A1 (0.64) MEN1KMT2AAKR1C3SLC16A3ALDH1A1
SCHEMBL3552742 0.84 MEN1 (0.63) MEN1KMT2AAKR1C3SLC16A3
SCHEMBL3561276 0.83 AKR1C3 (0.63) MEN1KMT2AAKR1C3SLC16A3ALDH1A1
SCHEMBL3560646 0.83 KDM4E (0.49) MEN1KMT2AAKR1C3SLC16A3SMN1; SMN2
SCHEMBL3556522 0.82 SLC16A3 (0.58) MEN1KMT2ASLC16A3ALDH1A1CA1

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 MEN1 2548/4885KMT2A 4045/4885AKR1C3 23/4885

“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.