SCHEMBL4912604

SCHEMBL4912604

O=C(NCCCn1ccnc1)c1ccccc1Oc1ncc(Cl)cc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 15/20 0.72
CYP3A4 P08684 3/20 0.72
CYP2C9 P11712 3/20 0.72
CYP2C19 P33261 3/20 0.72
CCR4 P51679 3/20 0.72
CYP1A2 P05177 1/20 0.62
CYP2D6 P10635 1/20 0.62
CCR5 P51681 1/20 0.62
ALDH1A1 P00352 2/20 0.60
KDM4E B2RXH2 1/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 1/20 0.52
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPK1 P28482 1/20 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
SCHEMBL11008653 0.85 ALDH1A1 (0.77) ALDH1A1KDM4ELMNAHPGDALOX15
SCHEMBL4909619 0.84 CCR2 (1.00) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4910021 0.84 CCR2 (0.87) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4903092 0.84 CCR2 (0.80) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4911750 0.83 CCR2 (0.78) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4907449 0.83 CCR2 (0.75) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4912645 0.82 CCR2 (1.00) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL14006426 0.82 CCR2 (0.75) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4911238 0.82 CCR2 (0.82) CCR2CYP3A4CYP2C9CYP2C19CCR4
SCHEMBL4910156 0.82 CCR2 (1.00) CCR2CYP3A4CYP2C9CYP2C19CCR4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293720-A1 Pyridinyl Sulfonamide Modulators of Chemokine Receptors GLAXO GROUP LIMITED (GB) 2008-11-27 US disclosed
US-20080293720-A1 Pyridinyl Sulfonamide Modulators of Chemokine Receptors GLAXO GROUP LIMITED (GB) 2008-11-27 US disclosed
US-20080293720-A1 Pyridinyl Sulfonamide Modulators of Chemokine Receptors GLAXO GROUP LIMITED (GB) 2008-11-27 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-20080293720-A1 Pyridinyl Sulfonamide Modulators of Chemokine Receptors CCR2, CCR1, CCRL2 CCR2 1/4885CYP3A4 1414/4885CYP2C9 1296/4885

“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.