SCHEMBL3563809

SCHEMBL3563809

O=C(O)c1ccc(OCCOc2ccc(NS(=O)(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
PKM P14618 2/20 0.62
MAPT P10636 2/20 0.62
AR P10275 1/20 0.62
GFER P55789 1/20 0.60
PGR P06401 1/20 0.57
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
LIMK2 P53671 1/20 0.56
TDP1 Q9NUW8 2/20 0.55
RECQL P46063 1/20 0.55
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CACNA1B Q00975 1/20 0.54
WDR5 P61964 1/20 0.54
POLB P06746 2/20 0.53
HDAC3 O15379 1/20 0.53

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
SCHEMBL3562032 0.88 SMN1; SMN2 (0.71) MEN1KMT2AMAPTGFERCA12
SCHEMBL3555882 0.88 GFER (0.79) MEN1KMT2AMAPTARGFER
SCHEMBL3553373 0.88 AR (0.62) MEN1KMT2AARGFERCA12
SCHEMBL3559760 0.88 HDAC1 (0.64) GFERPGRCA12CA1CA2
SCHEMBL3563348 0.88 ALDH1A1 (0.58) MEN1KMT2APKMMAPTAR
SCHEMBL3564900 0.87 ALDH1A1 (0.64) MEN1KMT2APKMMAPTPGR
SCHEMBL893905 0.87 CA12 (0.73) MEN1KMT2APKMMAPTGFER
SCHEMBL3556446 0.86 PGR (0.62) MEN1KMT2APKMMAPTGFER
SCHEMBL3556205 0.86 MAPT (0.64) MEN1KMT2AMAPTGFERTDP1
SCHEMBL3564489 0.86 GFER (0.60) MEN1KMT2AMAPTGFERCA12

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 4045/4885PKM 990/4885

“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.