SCHEMBL3554341

SCHEMBL3554341

O=C(O)c1ccccc1CCCCCc1ccccc1NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 5/20 0.59
CCR1 P32246 1/20 0.59
SLC16A3 O15427 8/20 0.57
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
METAP2 P50579 2/20 0.50

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
SCHEMBL3563326 0.96 CCR2 (0.60) CCR2CCR1SLC16A3MEN1KMT2A
SCHEMBL3553059 0.94 CCR2 (0.62) CCR2CCR1SLC16A3MEN1KMT2A
SCHEMBL3562322 0.91 SLC16A3 (0.56) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3564778 0.88 SLC16A3 (0.64) SLC16A3KDM4EALDH1A1METAP2
SCHEMBL3554689 0.88 SLC16A3 (0.64) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3554581 0.87 KDM4E (0.54) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3554787 0.87 SLC16A3 (0.51) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3556080 0.86 SLC16A3 (0.56) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3557805 0.86 SLC16A3 (0.65) SLC16A3MEN1KMT2AKDM4EALDH1A1
SCHEMBL3555224 0.85 ACLY (0.55) SLC16A3MEN1KMT2AKDM4EALDH1A1

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 CCR2 1793/4885CCR1 660/4885SLC16A3 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.