SCHEMBL3555657

SCHEMBL3555657

O=C(O)c1ccccc1CCCc1ccccc1NS(=O)(=O)c1ccc(S(=O)(=O)c2ccccc2)s1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
RECQL P46063 1/20 0.44
MCOLN3 Q8TDD5 1/20 0.44
SLC16A3 O15427 13/20 0.43
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CCR2 P41597 1/20 0.39

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
SCHEMBL3553027 0.95 MEN1 (0.45) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3555166 0.86 SLC16A3 (0.53) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3552834 0.86 MEN1 (0.45) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3557616 0.86 SLC16A3 (0.57) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3554581 0.84 KDM4E (0.54) MEN1KMT2APOLBSLC16A3KDM4E
SCHEMBL3557735 0.83 SLC16A3 (0.45) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3564863 0.81 SLC16A3 (0.61) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3556126 0.81 MEN1 (0.47) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3561797 0.81 HDAC1 (0.45) MEN1KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL3559525 0.81 SLC16A3 (0.65) MEN1KMT2ALMNAMAPTSMN1; SMN2

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 4045/4885LMNA 2120/4885

“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.