SCHEMBL956259

SCHEMBL956259

O=C(NS(=O)(=O)c1ccccc1)c1cc2nc(CCc3cccc(F)c3F)cc(O)n2n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.44
PTGS2 P35354 8/20 0.42
PTGS1 P23219 7/20 0.42
HPGD P15428 4/20 0.39
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
KAT6A Q92794 2/20 0.36
ALKBH2 Q6NS38 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
FTO Q9C0B1 1/20 0.36
AKR1C3 P42330 1/20 0.35
HSD17B10 Q99714 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL958612 0.84 CXCR2 (0.46) CXCR2HPGDKDM4EALDH1A1KAT6A
SCHEMBL957633 0.84 CXCR2 (0.52) CXCR2HPGDKDM4EALDH1A1HSD17B10
SCHEMBL955463 0.77 CXCR2 (0.42) CXCR2HPGDKDM4EALDH1A1HSD17B10
SCHEMBL959542 0.77 CXCR2 (0.52) CXCR2HPGDKDM4EALDH1A1HSD17B10
SCHEMBL956296 0.75 CXCR2 (0.56) CXCR2GAA
SCHEMBL956726 0.74 CXCR2 (0.53) CXCR2
SCHEMBL959381 0.74 CXCR2 (0.51) CXCR2
SCHEMBL956304 0.74 CXCR2 (0.72) CXCR2
SCHEMBL958516 0.74 CXCR2 (0.54) CXCR2ALDH1A1
SCHEMBL956581 0.74 CXCR2 (0.57) CXCR2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009429-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 NOVARTIS AG (CH) 2011-01-13 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-20110009429-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF CXCR2 CXCR2, CXCR1, CXCR3 CXCR2 1/4885PTGS2 236/4885PTGS1 171/4885

“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.