SCHEMBL7555940

SCHEMBL7555940

N#Cc1ccc(NC(=O)Nc2ccccc2C(F)(F)F)c(NS(=O)(=O)c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 6/20 0.52
IDH2 P48735 1/20 0.47
CXCR1 P25024 2/20 0.45
CXCR2 P25025 2/20 0.45
SCN9A Q15858 1/20 0.44
GRIK1 P39086 1/20 0.44
KMT2A Q03164 2/20 0.44
CCR2 P41597 1/20 0.44
GAA P10253 1/20 0.44
GPR27 Q9NS67 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TSHR P16473 1/20 0.43
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
ACLY P53396 1/20 0.42
PTGES2 Q9H7Z7 1/20 0.42

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
SCHEMBL7496445 0.86 ACLY (0.52) IDH2CXCR1CXCR2KMT2ACCR2
SCHEMBL7492157 0.85 IDH2 (0.48) SLC22A12IDH2CXCR1CXCR2KMT2A
SCHEMBL7486923 0.84 IDH2 (0.61) IDH2GRIK1KMT2AMEN1POLB
SCHEMBL3709166 0.84 CXCR2 (0.63) SLC22A12CXCR1CXCR2KMT2ACCR2
SCHEMBL7490402 0.84 GPR27 (0.51) SLC22A12CXCR1CXCR2KMT2ACCR2
SCHEMBL7940030 0.84 HDAC1 (0.50) SLC22A12CXCR1CXCR2CCR2GPR27
SCHEMBL7487824 0.84 TBXA2R (0.50) IDH2CXCR1CXCR2CCR2GAA
SCHEMBL7487915 0.83 CXCR1 (0.45) SLC22A12CXCR1CXCR2KMT2ACCR2
SCHEMBL7493701 0.83 STAT3 (0.51) SLC22A12CXCR1CXCR2CCR2GPR27
SCHEMBL7491182 0.81 GPR27 (0.51) CXCR1CXCR2KMT2ACCR2GAA

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-20020128321-A1 IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION 2002-09-12 US disclosed
US-6262113-B1 HYDROXY- OR MERCAPTO-PHENYLUREAS SMITHKLINE BEECHAM CORPORATION 2001-07-17 US disclosed
US-6211373-B1 Phenyl urea antagonists of the IL-8 receptor SMITHKLINE BEECHAM CORPORATION 2001-04-03 US disclosed
US-5780483-A IL-8 receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1998-07-14 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-20020128321-A1 IL-8 receptor antagonists CXCL8, CCR8, IL1RN SLC22A12 1654/4885IDH2 4348/4885CXCR1 21/4885

“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.