SCHEMBL3554581

SCHEMBL3554581

O=C(O)c1ccccc1CCCc1ccccc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
SLC16A3 O15427 8/20 0.53
METAP2 P50579 4/20 0.52
KMT2A Q03164 3/20 0.51
TSHR P16473 1/20 0.51
MEN1 O00255 2/20 0.50
ACLY P53396 1/20 0.50
POLB P06746 1/20 0.49

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
SCHEMBL3562322 0.96 SLC16A3 (0.56) KDM4EALDH1A1SLC16A3METAP2KMT2A
SCHEMBL3556581 0.94 SLC16A3 (0.58) KDM4EALDH1A1SLC16A3METAP2KMT2A
SCHEMBL3555224 0.92 ACLY (0.55) KDM4EALDH1A1SLC16A3KMT2AMEN1
SCHEMBL3558585 0.92 SLC16A3 (0.58) KDM4EALDH1A1SLC16A3KMT2AMEN1
SCHEMBL3563326 0.91 CCR2 (0.60) KDM4EALDH1A1SLC16A3METAP2KMT2A
SCHEMBL3555619 0.91 SLC16A3 (0.65) KDM4EALDH1A1SLC16A3METAP2KMT2A
SCHEMBL3561988 0.91 SLC16A3 (0.59) KDM4EALDH1A1SLC16A3METAP2TSHR
SCHEMBL3554531 0.89 CA12 (0.53) KDM4EALDH1A1SLC16A3METAP2KMT2A
SCHEMBL3552369 0.88 KDM4E (0.49) KDM4EALDH1A1SLC16A3KMT2AMEN1
SCHEMBL3556385 0.88 SLC16A3 (0.56) KDM4EALDH1A1SLC16A3KMT2ATSHR

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 KDM4E 1045/4885ALDH1A1 61/4885SLC16A3 425/4885

“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.