SCHEMBL17968340

SCHEMBL17968340

O=C1Cc2cc(S(=O)(=O)NCc3cc(Cl)c(Cl)cc3NS(=O)(=O)c3cccs3)ccc2N1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 11/20 0.51
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PKM P14618 2/20 0.45
GLO1 Q04760 1/20 0.44
SMYD3 Q9H7B4 2/20 0.41

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
SCHEMBL9931336 0.89 CCR2 (0.65) CCR2MAPTTDP1PKMGLO1
SCHEMBL9930635 0.80 CCR2 (0.64) CCR2PKM
SCHEMBL9930395 0.79 CCR2 (0.61) CCR2PKM
SCHEMBL24152420 0.77 HTR2C (0.61) MAPTTDP1PKMSMYD3
SCHEMBL9930527 0.71 CCR2 (0.61) CCR2PKM
SCHEMBL4907229 0.71 POLB (0.60) MAPTTDP1PKMSMYD3
SCHEMBL5843373 0.71 SMYD3 (0.53) MAPTTDP1PKMGLO1SMYD3
SCHEMBL3249962 0.70 PKM (0.54) MAPTTDP1PKMGLO1SMYD3
SCHEMBL9931337 0.69 CCR2 (0.72) CCR2PKM
SCHEMBL9930799 0.69 CCR2 (0.72) CCR2PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9603834-B2 1,2- bis-sulfonamide derivatives as chemokine receptor modulators ALLERGAN, INC. (US) 2017-03-28 US disclosed
US-20160228407-A1 NOVEL 1,2- BIS-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN, INC. 2016-08-11 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-20160228407-A1 NOVEL 1,2- BIS-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS CXCR2, CCR2, CX3CR1 CCR2 2/4885MAPT 4542/4885TDP1 4719/4885

“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.