SCHEMBL3563326

SCHEMBL3563326

O=C(O)c1ccccc1CCCc1ccccc1NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 5/20 0.60
CCR1 P32246 1/20 0.60
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 1/20 0.52
SLC16A3 O15427 5/20 0.52
METAP2 P50579 2/20 0.51

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
SCHEMBL3554341 0.96 CCR2 (0.59) CCR2CCR1MEN1KMT2AKDM4E
SCHEMBL3553059 0.95 CCR2 (0.62) CCR2CCR1MEN1KMT2AKDM4E
SCHEMBL3554581 0.91 KDM4E (0.54) MEN1KMT2AKDM4EALDH1A1SLC16A3
SCHEMBL3555224 0.89 ACLY (0.55) MEN1KMT2AKDM4EALDH1A1SLC16A3
SCHEMBL3558585 0.89 SLC16A3 (0.58) MEN1KMT2AKDM4EALDH1A1SLC16A3
SCHEMBL3561988 0.88 SLC16A3 (0.59) KDM4EALDH1A1SLC16A3METAP2
SCHEMBL3555619 0.88 SLC16A3 (0.65) CCR2MEN1KMT2AKDM4EALDH1A1
SCHEMBL3562322 0.87 SLC16A3 (0.56) MEN1KMT2AKDM4EALDH1A1SLC16A3
SCHEMBL3552369 0.87 KDM4E (0.49) CCR2CCR1MEN1KMT2AKDM4E
SCHEMBL3554531 0.86 CA12 (0.53) MEN1KMT2AKDM4EALDH1A1SLC16A3

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 660/4885MEN1 2548/4885

“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.